data_nef_c16284_2kio save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 16295 BMRB 6228 PDB 1w1n PDB 2kit stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 23 CYS SG 1 30 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ASN start . . 2 A 2 GLU middle . . 3 A 3 LEU middle . . 4 A 4 ASP middle . . 5 A 5 VAL middle . . 6 A 6 PRO middle . false 7 A 7 GLU middle . . 8 A 8 GLN middle . . 9 A 9 VAL middle . . 10 A 10 ASP middle . . 11 A 11 LYS middle . . 12 A 12 LEU middle . . 13 A 13 ILE middle . . 14 A 14 GLN middle . . 15 A 15 GLN middle . . 16 A 16 ALA middle . . 17 A 17 THR middle . . 18 A 18 SER middle . . 19 A 19 ILE middle . . 20 A 20 GLU middle . . 21 A 21 ARG middle . . 22 A 22 LEU middle . . 23 A 23 CYS middle -HG . 24 A 24 GLN middle . . 25 A 25 HIS middle . . 26 A 26 TYR middle . . 27 A 27 ILE middle . . 28 A 28 GLY middle . false 29 A 29 TRP middle . . 30 A 30 CYS middle -HG . 31 A 31 PRO middle . false 32 A 32 PHE middle . . 33 A 33 TRP end . . stop_ save_ save_assignments_y1fatc_dpc318 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assignments_y1fatc_dpc318 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ASN HA H 1 4.218 0.02 A 1 ASN HBy H 1 2.925 0.02 A 1 ASN HBx H 1 2.863 0.02 A 1 ASN HD2y H 1 7.708 0.02 A 1 ASN HD2x H 1 6.908 0.02 A 1 ASN CA C 13 53.215 0.1 A 1 ASN CB C 13 38.858 0.1 A 1 ASN ND2 N 15 112.651 0.1 A 2 GLU HA H 1 4.307 0.02 A 2 GLU HBy H 1 2.065 0.02 A 2 GLU HBx H 1 1.922 0.02 A 2 GLU HGx H 1 2.261 0.02 A 2 GLU CA C 13 57.017 0.1 A 2 GLU CB C 13 30.250 0.1 A 2 GLU CG C 13 36.259 0.1 A 3 LEU H H 1 8.219 0.02 A 3 LEU HA H 1 4.319 0.02 A 3 LEU HBy H 1 1.611 0.02 A 3 LEU HBx H 1 1.567 0.02 A 3 LEU HDx% H 1 0.851 0.02 A 3 LEU HDy% H 1 0.882 0.02 A 3 LEU HG H 1 1.593 0.02 A 3 LEU CA C 13 55.045 0.1 A 3 LEU CB C 13 42.732 0.1 A 3 LEU CDx C 13 23.995 0.1 A 3 LEU CDy C 13 25.202 0.1 A 3 LEU CG C 13 27.149 0.1 A 3 LEU N N 15 121.828 0.1 A 4 ASP H H 1 8.204 0.02 A 4 ASP HA H 1 4.654 0.02 A 4 ASP HB2 H 1 2.556 0.02 A 4 ASP HB3 H 1 2.732 0.02 A 4 ASP CA C 13 53.893 0.1 A 4 ASP CB C 13 41.340 0.1 A 4 ASP N N 15 122.456 0.1 A 5 VAL H H 1 8.174 0.02 A 5 VAL HA H 1 4.187 0.02 A 5 VAL HB H 1 2.107 0.02 A 5 VAL HGx% H 1 0.954 0.02 A 5 VAL HGy% H 1 0.929 0.02 A 5 VAL CA C 13 61.900 0.1 A 5 VAL CB C 13 31.966 0.1 A 5 VAL CGx C 13 21.400 0.1 A 5 VAL CGy C 13 21.600 0.1 A 5 VAL N N 15 120.681 0.1 A 6 PRO HA H 1 4.357 0.02 A 6 PRO HBy H 1 2.412 0.02 A 6 PRO HBx H 1 1.905 0.02 A 6 PRO HDy H 1 3.873 0.02 A 6 PRO HDx H 1 3.633 0.02 A 6 PRO HGy H 1 2.046 0.02 A 6 PRO HGx H 1 1.990 0.02 A 6 PRO CA C 13 64.196 0.1 A 6 PRO CB C 13 31.955 0.1 A 6 PRO CD C 13 50.564 0.1 A 6 PRO CG C 13 27.965 0.1 A 7 GLU H H 1 8.452 0.02 A 7 GLU HA H 1 4.139 0.02 A 7 GLU HBx H 1 2.051 0.02 A 7 GLU HGy H 1 2.327 0.02 A 7 GLU HGx H 1 2.239 0.02 A 7 GLU CA C 13 58.575 0.1 A 7 GLU CB C 13 29.976 0.1 A 7 GLU CG C 13 36.388 0.1 A 7 GLU N N 15 121.191 0.1 A 8 GLN H H 1 8.519 0.02 A 8 GLN HA H 1 4.175 0.02 A 8 GLN HBy H 1 2.101 0.02 A 8 GLN HBx H 1 2.043 0.02 A 8 GLN HE2y H 1 7.500 0.02 A 8 GLN HE2x H 1 6.810 0.02 A 8 GLN HGy H 1 2.487 0.02 A 8 GLN HGx H 1 2.422 0.02 A 8 GLN CA C 13 57.816 0.1 A 8 GLN CB C 13 28.805 0.1 A 8 GLN CG C 13 34.033 0.1 A 8 GLN N N 15 118.505 0.1 A 8 GLN NE2 N 15 111.587 0.1 A 9 VAL H H 1 7.956 0.02 A 9 VAL HA H 1 3.752 0.02 A 9 VAL HB H 1 2.146 0.02 A 9 VAL HGx% H 1 0.920 0.02 A 9 VAL HGy% H 1 0.961 0.02 A 9 VAL CA C 13 65.207 0.1 A 9 VAL CB C 13 31.851 0.1 A 9 VAL CGx C 13 21.600 0.1 A 9 VAL CGy C 13 22.443 0.1 A 9 VAL N N 15 118.861 0.1 A 10 ASP H H 1 8.068 0.02 A 10 ASP HA H 1 4.371 0.02 A 10 ASP HBx H 1 2.676 0.02 A 10 ASP CA C 13 56.822 0.1 A 10 ASP CB C 13 41.226 0.1 A 10 ASP N N 15 120.849 0.1 A 11 LYS H H 1 7.864 0.02 A 11 LYS HA H 1 4.040 0.02 A 11 LYS HBx H 1 1.851 0.02 A 11 LYS HDx H 1 1.662 0.02 A 11 LYS HEx H 1 2.960 0.02 A 11 LYS HGy H 1 1.552 0.02 A 11 LYS HGx H 1 1.437 0.02 A 11 LYS CA C 13 58.505 0.1 A 11 LYS CB C 13 32.500 0.1 A 11 LYS CD C 13 29.047 0.1 A 11 LYS CE C 13 42.220 0.1 A 11 LYS CG C 13 25.181 0.1 A 11 LYS N N 15 118.293 0.1 A 12 LEU H H 1 7.762 0.02 A 12 LEU HA H 1 4.146 0.02 A 12 LEU HB2 H 1 1.634 0.02 A 12 LEU HB3 H 1 1.835 0.02 A 12 LEU HDx% H 1 0.862 0.02 A 12 LEU HDy% H 1 0.903 0.02 A 12 LEU HG H 1 1.734 0.02 A 12 LEU CA C 13 57.449 0.1 A 12 LEU CB C 13 42.122 0.1 A 12 LEU CDx C 13 24.072 0.1 A 12 LEU CDy C 13 25.112 0.1 A 12 LEU CG C 13 27.066 0.1 A 12 LEU N N 15 120.247 0.1 A 13 ILE H H 1 8.004 0.02 A 13 ILE HA H 1 3.781 0.02 A 13 ILE HB H 1 1.995 0.02 A 13 ILE HD1% H 1 0.828 0.02 A 13 ILE HG1y H 1 1.654 0.02 A 13 ILE HG1x H 1 1.149 0.02 A 13 ILE HG2% H 1 0.884 0.02 A 13 ILE CA C 13 63.988 0.1 A 13 ILE CB C 13 37.884 0.1 A 13 ILE CD1 C 13 13.320 0.1 A 13 ILE CG1 C 13 28.684 0.1 A 13 ILE CG2 C 13 17.694 0.1 A 13 ILE N N 15 118.217 0.1 A 14 GLN H H 1 8.023 0.02 A 14 GLN HA H 1 4.125 0.02 A 14 GLN HB2 H 1 2.171 0.02 A 14 GLN HB3 H 1 2.090 0.02 A 14 GLN HE2y H 1 7.488 0.02 A 14 GLN HE2x H 1 6.743 0.02 A 14 GLN HGy H 1 2.489 0.02 A 14 GLN HGx H 1 2.428 0.02 A 14 GLN CA C 13 57.782 0.1 A 14 GLN CB C 13 28.805 0.1 A 14 GLN CG C 13 34.000 0.1 A 14 GLN N N 15 119.218 0.1 A 14 GLN NE2 N 15 112.366 0.1 A 15 GLN H H 1 7.890 0.02 A 15 GLN HA H 1 4.320 0.02 A 15 GLN HB2 H 1 2.211 0.02 A 15 GLN HB3 H 1 2.088 0.02 A 15 GLN HE2y H 1 7.321 0.02 A 15 GLN HE2x H 1 6.723 0.02 A 15 GLN HGx H 1 2.422 0.02 A 15 GLN CA C 13 56.357 0.1 A 15 GLN CB C 13 29.113 0.1 A 15 GLN CG C 13 34.050 0.1 A 15 GLN N N 15 117.615 0.1 A 15 GLN NE2 N 15 110.848 0.1 A 16 ALA H H 1 8.008 0.02 A 16 ALA HA H 1 4.256 0.02 A 16 ALA HB% H 1 1.460 0.02 A 16 ALA CA C 13 53.554 0.1 A 16 ALA CB C 13 18.916 0.1 A 16 ALA N N 15 123.069 0.1 A 17 THR H H 1 7.992 0.02 A 17 THR HA H 1 4.180 0.02 A 17 THR HB H 1 4.299 0.02 A 17 THR HG2% H 1 1.266 0.02 A 17 THR CA C 13 63.698 0.1 A 17 THR CB C 13 69.271 0.1 A 17 THR CG2 C 13 21.900 0.1 A 17 THR N N 15 111.819 0.1 A 18 SER H H 1 8.060 0.02 A 18 SER HA H 1 4.471 0.02 A 18 SER HB2 H 1 3.907 0.02 A 18 SER HB3 H 1 4.064 0.02 A 18 SER CA C 13 59.368 0.1 A 18 SER CB C 13 63.694 0.1 A 18 SER N N 15 116.820 0.1 A 19 ILE H H 1 8.348 0.02 A 19 ILE HA H 1 3.797 0.02 A 19 ILE HB H 1 2.051 0.02 A 19 ILE HD1% H 1 0.899 0.02 A 19 ILE HG1y H 1 1.697 0.02 A 19 ILE HG1x H 1 1.300 0.02 A 19 ILE HG2% H 1 0.992 0.02 A 19 ILE CA C 13 63.988 0.1 A 19 ILE CB C 13 37.153 0.1 A 19 ILE CD1 C 13 12.832 0.1 A 19 ILE CG1 C 13 28.955 0.1 A 19 ILE CG2 C 13 18.232 0.1 A 19 ILE N N 15 122.956 0.1 A 20 GLU H H 1 8.144 0.02 A 20 GLU HA H 1 3.136 0.02 A 20 GLU HBx H 1 1.203 0.02 A 20 GLU HGy H 1 1.834 0.02 A 20 GLU HGx H 1 1.691 0.02 A 20 GLU CA C 13 59.744 0.1 A 20 GLU CB C 13 31.590 0.1 A 20 GLU CG C 13 35.359 0.1 A 20 GLU N N 15 122.206 0.1 A 21 ARG H H 1 7.712 0.02 A 21 ARG HA H 1 3.989 0.02 A 21 ARG HBx H 1 1.869 0.02 A 21 ARG HDx H 1 3.192 0.02 A 21 ARG HGy H 1 1.698 0.02 A 21 ARG HGx H 1 1.601 0.02 A 21 ARG CA C 13 58.925 0.1 A 21 ARG CB C 13 29.979 0.1 A 21 ARG CD C 13 43.349 0.1 A 21 ARG CG C 13 27.570 0.1 A 21 ARG N N 15 118.031 0.1 A 22 LEU H H 1 7.955 0.02 A 22 LEU HA H 1 4.233 0.02 A 22 LEU HB2 H 1 1.641 0.02 A 22 LEU HB3 H 1 2.014 0.02 A 22 LEU HDx% H 1 0.990 0.02 A 22 LEU HDy% H 1 0.937 0.02 A 22 LEU HG H 1 1.900 0.02 A 22 LEU CA C 13 58.297 0.1 A 22 LEU CB C 13 42.470 0.1 A 22 LEU CDx C 13 24.232 0.1 A 22 LEU CDy C 13 25.813 0.1 A 22 LEU CG C 13 26.975 0.1 A 22 LEU N N 15 120.166 0.1 A 23 CYS H H 1 8.634 0.02 A 23 CYS HA H 1 4.150 0.02 A 23 CYS HBy H 1 3.291 0.02 A 23 CYS HBx H 1 3.221 0.02 A 23 CYS CA C 13 60.813 0.1 A 23 CYS CB C 13 41.569 0.1 A 23 CYS N N 15 117.824 0.1 A 24 GLN H H 1 8.448 0.02 A 24 GLN HA H 1 3.924 0.02 A 24 GLN HBy H 1 2.109 0.02 A 24 GLN HBx H 1 2.050 0.02 A 24 GLN HE2y H 1 7.374 0.02 A 24 GLN HE2x H 1 6.656 0.02 A 24 GLN HGy H 1 2.510 0.02 A 24 GLN HGx H 1 2.418 0.02 A 24 GLN CA C 13 59.043 0.1 A 24 GLN CB C 13 28.204 0.1 A 24 GLN CG C 13 33.435 0.1 A 24 GLN N N 15 121.235 0.1 A 24 GLN NE2 N 15 110.640 0.1 A 25 HIS H H 1 7.911 0.02 A 25 HIS HA H 1 4.284 0.02 A 25 HIS HB2 H 1 2.802 0.02 A 25 HIS HB3 H 1 3.027 0.02 A 25 HIS CA C 13 58.623 0.1 A 25 HIS CB C 13 30.843 0.1 A 25 HIS N N 15 115.584 0.1 A 26 TYR H H 1 8.030 0.02 A 26 TYR HA H 1 4.449 0.02 A 26 TYR HB2 H 1 3.067 0.02 A 26 TYR HB3 H 1 2.859 0.02 A 26 TYR HDx H 1 7.296 0.02 A 26 TYR HDy H 1 7.296 0.02 A 26 TYR HEx H 1 6.833 0.02 A 26 TYR HEy H 1 6.833 0.02 A 26 TYR CA C 13 60.020 0.1 A 26 TYR CB C 13 39.612 0.1 A 26 TYR CDx C 13 133.172 0.1 A 26 TYR CDy C 13 133.172 0.1 A 26 TYR CEx C 13 118.204 0.1 A 26 TYR CEy C 13 118.204 0.1 A 26 TYR N N 15 114.240 0.1 A 27 ILE H H 1 7.866 0.02 A 27 ILE HA H 1 4.326 0.02 A 27 ILE HB H 1 2.410 0.02 A 27 ILE HD1% H 1 0.941 0.02 A 27 ILE HG1y H 1 1.639 0.02 A 27 ILE HG1x H 1 1.289 0.02 A 27 ILE HG2% H 1 1.090 0.02 A 27 ILE CA C 13 62.316 0.1 A 27 ILE CB C 13 38.441 0.1 A 27 ILE CD1 C 13 12.591 0.1 A 27 ILE CG1 C 13 27.940 0.1 A 27 ILE CG2 C 13 18.113 0.1 A 27 ILE N N 15 116.156 0.1 A 28 GLY H H 1 8.317 0.02 A 28 GLY HAy H 1 4.244 0.02 A 28 GLY HAx H 1 3.768 0.02 A 28 GLY CA C 13 45.732 0.1 A 28 GLY N N 15 107.149 0.1 A 29 TRP H H 1 7.166 0.02 A 29 TRP HA H 1 4.654 0.02 A 29 TRP HBy H 1 3.239 0.02 A 29 TRP HBx H 1 3.085 0.02 A 29 TRP HD1 H 1 7.279 0.02 A 29 TRP HE1 H 1 10.534 0.02 A 29 TRP HE3 H 1 7.495 0.02 A 29 TRP HH2 H 1 7.038 0.02 A 29 TRP HZ2 H 1 7.436 0.02 A 29 TRP HZ3 H 1 6.900 0.02 A 29 TRP CA C 13 57.861 0.1 A 29 TRP CB C 13 29.596 0.1 A 29 TRP CD1 C 13 126.839 0.1 A 29 TRP CE3 C 13 120.992 0.1 A 29 TRP CH2 C 13 123.916 0.1 A 29 TRP CZ2 C 13 114.415 0.1 A 29 TRP CZ3 C 13 120.992 0.1 A 29 TRP N N 15 121.864 0.1 A 29 TRP NE1 N 15 130.837 0.1 A 30 CYS H H 1 8.044 0.02 A 30 CYS HA H 1 4.831 0.02 A 30 CYS HB2 H 1 3.161 0.02 A 30 CYS HB3 H 1 3.011 0.02 A 30 CYS CA C 13 52.307 0.1 A 30 CYS CB C 13 44.287 0.1 A 30 CYS N N 15 119.218 0.1 A 31 PRO HA H 1 4.218 0.02 A 31 PRO HBy H 1 1.635 0.02 A 31 PRO HBx H 1 1.513 0.02 A 31 PRO HDy H 1 2.841 0.02 A 31 PRO HDx H 1 2.604 0.02 A 31 PRO HGy H 1 1.034 0.02 A 31 PRO HGx H 1 0.752 0.02 A 31 PRO CA C 13 63.680 0.1 A 31 PRO CB C 13 31.226 0.1 A 31 PRO CD C 13 49.818 0.1 A 31 PRO CG C 13 26.244 0.1 A 32 PHE H H 1 6.394 0.02 A 32 PHE HA H 1 4.205 0.02 A 32 PHE HBx H 1 2.676 0.02 A 32 PHE HDx H 1 6.900 0.02 A 32 PHE HDy H 1 6.900 0.02 A 32 PHE HEy H 1 7.141 0.02 A 32 PHE HEx H 1 7.140 0.02 A 32 PHE HZ H 1 7.061 0.02 A 32 PHE CA C 13 57.337 0.1 A 32 PHE CB C 13 38.535 0.1 A 32 PHE CDx C 13 131.224 0.1 A 32 PHE CDy C 13 131.224 0.1 A 32 PHE CEx C 13 130.980 0.1 A 32 PHE CEy C 13 130.980 0.1 A 32 PHE CZ C 13 129.275 0.1 A 32 PHE N N 15 115.357 0.1 A 33 TRP H H 1 7.152 0.02 A 33 TRP HA H 1 4.432 0.02 A 33 TRP HB2 H 1 3.319 0.02 A 33 TRP HB3 H 1 2.990 0.02 A 33 TRP HD1 H 1 7.260 0.02 A 33 TRP HE1 H 1 10.423 0.02 A 33 TRP HE3 H 1 7.554 0.02 A 33 TRP HH2 H 1 6.986 0.02 A 33 TRP HZ2 H 1 7.371 0.02 A 33 TRP HZ3 H 1 7.088 0.02 A 33 TRP CA C 13 59.978 0.1 A 33 TRP CB C 13 30.927 0.1 A 33 TRP CD1 C 13 127.326 0.1 A 33 TRP CE3 C 13 120.749 0.1 A 33 TRP CH2 C 13 123.185 0.1 A 33 TRP CZ2 C 13 114.902 0.1 A 33 TRP CZ3 C 13 120.505 0.1 A 33 TRP N N 15 123.725 0.1 A 33 TRP NE1 N 15 130.589 0.1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 26 TYR HD% A 26 TYR HB3 1.0 1.8 2.8 2 1 A 26 TYR HD% A 25 HIS HB2 1.0 1.8 2.8 3 2 A 26 TYR HD% A 26 TYR HB2 1.0 1.8 2.8 4 2 A 26 TYR HD% A 25 HIS HB3 1.0 1.8 2.8 5 3 A 33 TRP HE3 A 33 TRP HB2 1.0 1.8 2.8 6 3 A 33 TRP HE3 A 30 CYS HB2 1.0 1.8 2.8 7 4 A 26 TYR HD% A 22 LEU HA 1.0 1.8 2.8 8 5 A 26 TYR HD% A 22 LEU HB3 1.0 1.8 3.5 9 6 A 26 TYR HD% A 22 LEU HB3 1.0 1.8 3.5 10 7 A 26 TYR HD% A 22 LEU HDx% 1.0 1.8 3.5 11 8 A 26 TYR HD% A 22 LEU HG 1.0 1.8 3.5 12 9 A 22 LEU HA A 26 TYR HE% 1.0 1.8 3.5 13 10 A 22 LEU HB3 A 26 TYR HE% 1.0 1.8 4.5 14 11 A 26 TYR HE% A 22 LEU HDx% 1.0 1.8 2.8 15 11 A 26 TYR HE% A 22 LEU HDy% 1.0 1.8 2.8 16 12 A 25 HIS HB3 A 26 TYR HE% 1.0 1.8 4.5 17 13 A 26 TYR HD% A 26 TYR HA 1.0 1.8 2.8 18 14 A 26 TYR HD% A 26 TYR HE% 1.0 1.8 2.8 19 15 A 29 TRP HD1 A 29 TRP HA 1.0 1.8 2.8 20 16 A 29 TRP HD1 A 29 TRP HBx 1.0 1.8 3.5 21 16 A 29 TRP HD1 A 29 TRP HBy 1.0 1.8 3.5 22 17 A 29 TRP HD1 A 29 TRP HBx 1.0 1.8 3.5 23 17 A 29 TRP HD1 A 29 TRP HBy 1.0 1.8 3.5 24 18 A 29 TRP HD1 A 29 TRP HE1 1.0 1.8 2.8 25 19 A 29 TRP HA A 29 TRP HE3 1.0 1.8 4.5 26 20 A 29 TRP HE3 A 29 TRP HBx 1.0 1.8 3.5 27 20 A 29 TRP HBy A 29 TRP HE3 1.0 1.8 3.5 28 21 A 29 TRP HE3 A 29 TRP HBx 1.0 1.8 4.5 29 21 A 29 TRP HBy A 29 TRP HE3 1.0 1.8 4.5 30 22 A 29 TRP HE1 A 29 TRP HZ2 1.0 1.8 2.8 31 23 A 29 TRP HZ2 A 29 TRP HH2 1.0 1.8 2.8 32 24 A 29 TRP HZ2 A 29 TRP HH2 1.0 1.8 2.8 33 25 A 29 TRP HZ3 A 29 TRP HBx 1.0 1.8 4.5 34 25 A 29 TRP HBy A 29 TRP HZ3 1.0 1.8 4.5 35 26 A 29 TRP HZ3 A 29 TRP HBx 1.0 1.8 4.5 36 26 A 29 TRP HBy A 29 TRP HZ3 1.0 1.8 4.5 37 27 A 29 TRP HE3 A 29 TRP HZ3 1.0 1.8 2.8 38 28 A 29 TRP HE3 A 29 TRP HZ3 1.0 1.8 2.8 39 29 A 29 TRP HH2 A 29 TRP HZ3 1.0 1.8 2.8 40 30 A 32 PHE HD% A 32 PHE HA 1.0 1.8 2.8 41 31 A 32 PHE HD% A 32 PHE HBx 1.0 1.8 3.5 42 31 A 32 PHE HD% A 32 PHE HBy 1.0 1.8 3.5 43 32 A 32 PHE HD% A 32 PHE HE% 1.0 1.8 2.8 44 33 A 32 PHE HD% A 32 PHE HE% 1.0 1.8 2.8 45 34 A 32 PHE HE% A 32 PHE HZ 1.0 1.8 2.8 46 35 A 33 TRP HH2 A 19 ILE HG2% 1.0 1.8 3.5 47 36 A 33 TRP HZ2 A 19 ILE HB 1.0 1.8 2.8 48 37 A 19 ILE HG2% A 33 TRP HZ2 1.0 1.8 2.8 49 38 A 33 TRP HE3 A 30 CYS HA 1.0 1.8 4.5 50 39 A 33 TRP HE3 A 30 CYS HB3 1.0 1.8 4.5 51 40 A 30 CYS HA A 33 TRP HZ3 1.0 1.8 4.5 52 41 A 30 CYS HB3 A 33 TRP HZ3 1.0 1.8 3.5 53 42 A 30 CYS HB2 A 33 TRP HZ3 1.0 1.8 4.5 54 43 A 33 TRP HD1 A 33 TRP HA 1.0 1.8 3.5 55 44 A 33 TRP HD1 A 33 TRP HB3 1.0 1.8 2.8 56 45 A 33 TRP HB2 A 33 TRP HD1 1.0 1.8 3.5 57 46 A 33 TRP HD1 A 33 TRP HE1 1.0 1.8 2.8 58 47 A 33 TRP HE3 A 33 TRP HB3 1.0 1.8 4.5 59 48 A 33 TRP HZ2 A 33 TRP HE1 1.0 1.8 2.8 60 49 A 33 TRP HH2 A 33 TRP HZ2 1.0 1.8 2.8 61 50 A 33 TRP HH2 A 33 TRP HZ2 1.0 1.8 2.8 62 51 A 33 TRP HE3 A 33 TRP HZ3 1.0 1.8 2.8 63 52 A 33 TRP HE3 A 33 TRP HZ3 1.0 1.8 2.8 64 53 A 33 TRP HH2 A 33 TRP HZ3 1.0 1.8 2.8 65 54 A 3 LEU HG A 3 LEU HA 1.0 1.8 4.5 66 54 A 3 LEU HG A 2 GLU HA 1.0 1.8 4.5 67 55 A 3 LEU HBx A 3 LEU HDx% 1.0 1.8 2.8 68 55 A 3 LEU HBy A 3 LEU HDx% 1.0 1.8 2.8 69 55 A 3 LEU HG A 3 LEU HDx% 1.0 1.8 2.8 70 56 A 3 LEU HBy A 3 LEU HDy% 1.0 1.8 2.8 71 56 A 3 LEU HG A 3 LEU HDy% 1.0 1.8 2.8 72 56 A 3 LEU HDy% A 3 LEU HBx 1.0 1.8 2.8 73 57 A 4 ASP H A 3 LEU HBx 1.0 1.8 3.5 74 57 A 3 LEU HBy A 4 ASP H 1.0 1.8 3.5 75 57 A 3 LEU HBy A 3 LEU H 1.0 1.8 3.5 76 57 A 3 LEU H A 3 LEU HBx 1.0 1.8 3.5 77 58 A 4 ASP H A 3 LEU HBx 1.0 1.8 3.5 78 58 A 3 LEU HBy A 4 ASP H 1.0 1.8 3.5 79 58 A 3 LEU HBy A 3 LEU H 1.0 1.8 3.5 80 58 A 3 LEU H A 3 LEU HBx 1.0 1.8 3.5 81 59 A 3 LEU HG A 4 ASP H 1.0 1.8 4.5 82 59 A 3 LEU HG A 3 LEU H 1.0 1.8 4.5 83 60 A 5 VAL H A 4 ASP HB3 1.0 1.8 3.5 84 60 A 4 ASP H A 4 ASP HB3 1.0 1.8 3.5 85 61 A 5 VAL H A 4 ASP HB2 1.0 1.8 3.5 86 61 A 4 ASP H A 4 ASP HB2 1.0 1.8 3.5 87 62 A 6 PRO HDy A 9 VAL HGx% 1.0 1.8 3.5 88 62 A 6 PRO HDx A 5 VAL HGy% 1.0 1.8 3.5 89 62 A 5 VAL HGy% A 6 PRO HDy 1.0 1.8 3.5 90 62 A 6 PRO HDx A 9 VAL HGx% 1.0 1.8 3.5 91 62 A 5 VAL HGx% A 6 PRO HDy 1.0 1.8 3.5 92 62 A 6 PRO HDx A 5 VAL HGx% 1.0 1.8 3.5 93 63 A 6 PRO HDy A 9 VAL HGx% 1.0 1.8 2.8 94 63 A 6 PRO HDx A 5 VAL HGy% 1.0 1.8 2.8 95 63 A 5 VAL HGy% A 6 PRO HDy 1.0 1.8 2.8 96 63 A 6 PRO HDx A 9 VAL HGx% 1.0 1.8 2.8 97 63 A 5 VAL HGx% A 6 PRO HDy 1.0 1.8 2.8 98 63 A 6 PRO HDx A 5 VAL HGx% 1.0 1.8 2.8 99 64 A 9 VAL H A 9 VAL HGx% 1.0 1.8 2.8 100 64 A 13 ILE H A 9 VAL HGx% 1.0 1.8 2.8 101 64 A 10 ASP H A 9 VAL HGx% 1.0 1.8 2.8 102 65 A 13 ILE HG1x A 13 ILE HG2% 1.0 1.8 2.8 103 65 A 13 ILE HG1x A 13 ILE HD1% 1.0 1.8 2.8 104 66 A 13 ILE HG2% A 13 ILE HG1y 1.0 1.8 2.8 105 66 A 13 ILE HD1% A 13 ILE HG1y 1.0 1.8 2.8 106 67 A 13 ILE HA A 14 GLN H 1.0 1.8 2.8 107 67 A 13 ILE H A 13 ILE HA 1.0 1.8 2.8 108 68 A 14 GLN H A 13 ILE HB 1.0 1.8 2.8 109 68 A 13 ILE H A 13 ILE HB 1.0 1.8 2.8 110 69 A 13 ILE HG1x A 14 GLN H 1.0 1.8 3.5 111 69 A 13 ILE H A 13 ILE HG1x 1.0 1.8 3.5 112 70 A 13 ILE HG1y A 14 GLN H 1.0 1.8 4.5 113 70 A 13 ILE H A 13 ILE HG1y 1.0 1.8 4.5 114 71 A 16 ALA HB% A 19 ILE HD1% 1.0 1.8 2.8 115 71 A 13 ILE HG2% A 16 ALA HB% 1.0 1.8 2.8 116 72 A 13 ILE HG2% A 16 ALA H 1.0 1.8 2.8 117 72 A 13 ILE HG2% A 14 GLN H 1.0 1.8 2.8 118 72 A 13 ILE H A 13 ILE HG2% 1.0 1.8 2.8 119 73 A 16 ALA HA A 17 THR H 1.0 1.8 4.5 120 73 A 16 ALA H A 16 ALA HA 1.0 1.8 4.5 121 74 A 16 ALA HB% A 17 THR H 1.0 1.8 2.8 122 74 A 16 ALA HB% A 16 ALA H 1.0 1.8 2.8 123 75 A 17 THR HA A 18 SER H 1.0 1.8 4.5 124 75 A 17 THR H A 17 THR HA 1.0 1.8 4.5 125 76 A 18 SER H A 17 THR HB 1.0 1.8 5.5 126 76 A 17 THR H A 17 THR HB 1.0 1.8 5.5 127 77 A 18 SER H A 17 THR HG2% 1.0 1.8 2.8 128 77 A 17 THR H A 17 THR HG2% 1.0 1.8 2.8 129 78 A 19 ILE HB A 22 LEU HDx% 1.0 1.8 2.8 130 78 A 19 ILE HG2% A 19 ILE HB 1.0 1.8 2.8 131 79 A 22 LEU HB3 A 22 LEU HDx% 1.0 1.8 2.8 132 79 A 19 ILE HG1x A 22 LEU HDx% 1.0 1.8 2.8 133 80 A 22 LEU HDy% A 19 ILE HB 1.0 1.8 3.5 134 80 A 19 ILE HB A 19 ILE HD1% 1.0 1.8 3.5 135 81 A 21 ARG HA A 24 GLN HBy 1.0 1.8 2.8 136 81 A 24 GLN HA A 24 GLN HBy 1.0 1.8 2.8 137 81 A 24 GLN HBx A 24 GLN HA 1.0 1.8 2.8 138 81 A 24 GLN HBx A 21 ARG HA 1.0 1.8 2.8 139 82 A 21 ARG HA A 24 GLN HBy 1.0 1.8 2.8 140 82 A 24 GLN HA A 24 GLN HBy 1.0 1.8 2.8 141 82 A 24 GLN HBx A 24 GLN HA 1.0 1.8 2.8 142 82 A 24 GLN HBx A 21 ARG HA 1.0 1.8 2.8 143 83 A 25 HIS HB3 A 25 HIS HA 1.0 1.8 3.5 144 83 A 25 HIS HB3 A 22 LEU HA 1.0 1.8 3.5 145 84 A 25 HIS HB2 A 25 HIS HA 1.0 1.8 2.8 146 84 A 25 HIS HB2 A 22 LEU HA 1.0 1.8 2.8 147 85 A 22 LEU HA A 25 HIS H 1.0 1.8 4.5 148 85 A 22 LEU HA A 22 LEU H 1.0 1.8 4.5 149 86 A 3 LEU HA A 3 LEU HBx 1.0 1.8 3.5 150 86 A 3 LEU HA A 3 LEU HBy 1.0 1.8 3.5 151 87 A 3 LEU HA A 3 LEU HBx 1.0 1.8 3.5 152 87 A 3 LEU HA A 3 LEU HBy 1.0 1.8 3.5 153 88 A 3 LEU HA A 3 LEU HDx% 1.0 1.8 3.5 154 89 A 3 LEU HBx A 3 LEU HDx% 1.0 1.8 2.8 155 89 A 3 LEU HBy A 3 LEU HDx% 1.0 1.8 2.8 156 89 A 3 LEU HDy% A 3 LEU HBx 1.0 1.8 2.8 157 89 A 3 LEU HBy A 3 LEU HDy% 1.0 1.8 2.8 158 90 A 3 LEU HBx A 3 LEU HDx% 1.0 1.8 2.8 159 90 A 3 LEU HBy A 3 LEU HDx% 1.0 1.8 2.8 160 90 A 3 LEU HDy% A 3 LEU HBx 1.0 1.8 2.8 161 90 A 3 LEU HBy A 3 LEU HDy% 1.0 1.8 2.8 162 91 A 3 LEU HG A 3 LEU HDx% 1.0 1.8 4.5 163 91 A 3 LEU HG A 3 LEU HDy% 1.0 1.8 4.5 164 92 A 2 GLU HBx A 4 ASP HB3 1.0 1.8 4.5 165 92 A 2 GLU HBy A 4 ASP HB3 1.0 1.8 4.5 166 93 A 2 GLU HBx A 4 ASP HB2 1.0 1.8 4.5 167 93 A 4 ASP HB2 A 2 GLU HBy 1.0 1.8 4.5 168 94 A 4 ASP HA A 4 ASP HB3 1.0 1.8 3.5 169 95 A 4 ASP HA A 4 ASP HB2 1.0 1.8 3.5 170 96 A 5 VAL HB A 5 VAL HA 1.0 1.8 3.5 171 97 A 5 VAL HA A 5 VAL HGx% 1.0 1.8 3.5 172 97 A 5 VAL HA A 5 VAL HGy% 1.0 1.8 3.5 173 98 A 5 VAL HA A 5 VAL HGx% 1.0 1.8 2.8 174 98 A 5 VAL HA A 5 VAL HGy% 1.0 1.8 2.8 175 99 A 5 VAL HB A 5 VAL HGx% 1.0 1.8 2.8 176 99 A 5 VAL HB A 5 VAL HGy% 1.0 1.8 2.8 177 100 A 5 VAL HB A 5 VAL HGx% 1.0 1.8 2.8 178 100 A 5 VAL HB A 5 VAL HGy% 1.0 1.8 2.8 179 101 A 5 VAL H A 5 VAL HA 1.0 1.8 5.5 180 102 A 5 VAL H A 5 VAL HB 1.0 1.8 2.8 181 103 A 5 VAL H A 5 VAL HGx% 1.0 1.8 2.8 182 103 A 5 VAL H A 5 VAL HGy% 1.0 1.8 2.8 183 104 A 5 VAL HA A 6 PRO HDy 1.0 1.8 3.5 184 104 A 6 PRO HDx A 5 VAL HA 1.0 1.8 3.5 185 105 A 5 VAL HA A 6 PRO HDy 1.0 1.8 4.5 186 105 A 6 PRO HDx A 5 VAL HA 1.0 1.8 4.5 187 106 A 5 VAL HA A 6 PRO HDy 1.0 1.8 3.5 188 106 A 6 PRO HDx A 5 VAL HA 1.0 1.8 3.5 189 107 A 5 VAL HA A 6 PRO HDy 1.0 1.8 3.5 190 107 A 6 PRO HDx A 5 VAL HA 1.0 1.8 3.5 191 108 A 5 VAL HB A 6 PRO HDy 1.0 1.8 2.8 192 108 A 6 PRO HDx A 5 VAL HB 1.0 1.8 2.8 193 109 A 5 VAL HB A 6 PRO HDy 1.0 1.8 3.5 194 109 A 6 PRO HDx A 5 VAL HB 1.0 1.8 3.5 195 110 A 5 VAL HGy% A 6 PRO HDy 1.0 1.8 3.5 196 110 A 5 VAL HGx% A 6 PRO HDy 1.0 1.8 3.5 197 110 A 6 PRO HDx A 5 VAL HGx% 1.0 1.8 3.5 198 110 A 6 PRO HDx A 5 VAL HGy% 1.0 1.8 3.5 199 111 A 5 VAL HGy% A 6 PRO HDy 1.0 1.8 3.5 200 111 A 5 VAL HGx% A 6 PRO HDy 1.0 1.8 3.5 201 111 A 6 PRO HDx A 5 VAL HGx% 1.0 1.8 3.5 202 111 A 6 PRO HDx A 5 VAL HGy% 1.0 1.8 3.5 203 112 A 5 VAL H A 6 PRO HDy 1.0 1.8 4.5 204 112 A 5 VAL H A 6 PRO HDx 1.0 1.8 4.5 205 113 A 5 VAL H A 6 PRO HDy 1.0 1.8 3.5 206 113 A 5 VAL H A 6 PRO HDx 1.0 1.8 3.5 207 114 A 5 VAL HA A 6 PRO HGx 1.0 1.8 5.5 208 114 A 5 VAL HA A 6 PRO HGy 1.0 1.8 5.5 209 115 A 6 PRO HA A 6 PRO HBy 1.0 1.8 2.8 210 115 A 6 PRO HBx A 6 PRO HA 1.0 1.8 2.8 211 116 A 6 PRO HA A 6 PRO HBy 1.0 1.8 3.5 212 116 A 6 PRO HBx A 6 PRO HA 1.0 1.8 3.5 213 117 A 6 PRO HBy A 6 PRO HDy 1.0 1.8 4.5 214 117 A 6 PRO HBx A 6 PRO HDy 1.0 1.8 4.5 215 117 A 6 PRO HDx A 6 PRO HBy 1.0 1.8 4.5 216 117 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 4.5 217 118 A 6 PRO HBy A 6 PRO HDy 1.0 1.8 4.5 218 118 A 6 PRO HBx A 6 PRO HDy 1.0 1.8 4.5 219 118 A 6 PRO HDx A 6 PRO HBy 1.0 1.8 4.5 220 118 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 4.5 221 119 A 6 PRO HBy A 6 PRO HDy 1.0 1.8 4.5 222 119 A 6 PRO HBx A 6 PRO HDy 1.0 1.8 4.5 223 119 A 6 PRO HDx A 6 PRO HBy 1.0 1.8 4.5 224 119 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 4.5 225 120 A 6 PRO HBy A 6 PRO HDy 1.0 1.8 3.5 226 120 A 6 PRO HBx A 6 PRO HDy 1.0 1.8 3.5 227 120 A 6 PRO HDx A 6 PRO HBy 1.0 1.8 3.5 228 120 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 3.5 229 121 A 6 PRO HA A 6 PRO HGx 1.0 1.8 3.5 230 121 A 6 PRO HGy A 6 PRO HA 1.0 1.8 3.5 231 122 A 6 PRO HA A 6 PRO HGx 1.0 1.8 3.5 232 122 A 6 PRO HGy A 6 PRO HA 1.0 1.8 3.5 233 123 A 6 PRO HBy A 6 PRO HGx 1.0 1.8 2.8 234 123 A 6 PRO HGy A 6 PRO HBy 1.0 1.8 2.8 235 123 A 6 PRO HGy A 6 PRO HBx 1.0 1.8 2.8 236 123 A 6 PRO HBx A 6 PRO HGx 1.0 1.8 2.8 237 124 A 6 PRO HBy A 6 PRO HGx 1.0 1.8 2.8 238 124 A 6 PRO HGy A 6 PRO HBy 1.0 1.8 2.8 239 124 A 6 PRO HGy A 6 PRO HBx 1.0 1.8 2.8 240 124 A 6 PRO HBx A 6 PRO HGx 1.0 1.8 2.8 241 125 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 2.8 242 125 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 2.8 243 125 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 2.8 244 125 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 2.8 245 126 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 2.8 246 126 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 2.8 247 126 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 2.8 248 126 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 2.8 249 127 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 2.8 250 127 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 2.8 251 127 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 2.8 252 127 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 2.8 253 128 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 3.5 254 128 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 3.5 255 128 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 3.5 256 128 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 3.5 257 129 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 2.8 258 129 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 2.8 259 129 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 2.8 260 129 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 2.8 261 130 A 6 PRO HDy A 6 PRO HGx 1.0 1.8 2.8 262 130 A 6 PRO HDx A 6 PRO HGx 1.0 1.8 2.8 263 130 A 6 PRO HGy A 6 PRO HDy 1.0 1.8 2.8 264 130 A 6 PRO HDx A 6 PRO HGy 1.0 1.8 2.8 265 131 A 7 GLU H A 6 PRO HBy 1.0 1.8 5.5 266 131 A 6 PRO HBx A 7 GLU H 1.0 1.8 5.5 267 132 A 7 GLU H A 6 PRO HBy 1.0 1.8 4.5 268 132 A 6 PRO HBx A 7 GLU H 1.0 1.8 4.5 269 133 A 7 GLU HA A 7 GLU HBx 1.0 1.8 2.8 270 133 A 7 GLU HBy A 7 GLU HA 1.0 1.8 2.8 271 134 A 7 GLU HGx A 7 GLU HBx 1.0 1.8 2.8 272 134 A 7 GLU HBy A 7 GLU HGx 1.0 1.8 2.8 273 135 A 7 GLU HA A 7 GLU HGy 1.0 1.8 4.5 274 135 A 7 GLU HA A 7 GLU HGx 1.0 1.8 4.5 275 136 A 7 GLU HA A 7 GLU HGy 1.0 1.8 3.5 276 136 A 7 GLU HA A 7 GLU HGx 1.0 1.8 3.5 277 137 A 7 GLU HBx A 7 GLU HGy 1.0 1.8 2.8 278 137 A 7 GLU HBy A 7 GLU HGy 1.0 1.8 2.8 279 137 A 7 GLU HGx A 7 GLU HBx 1.0 1.8 2.8 280 137 A 7 GLU HBy A 7 GLU HGx 1.0 1.8 2.8 281 138 A 7 GLU HBx A 7 GLU HGy 1.0 1.8 2.8 282 138 A 7 GLU HBy A 7 GLU HGy 1.0 1.8 2.8 283 138 A 7 GLU HGx A 7 GLU HBx 1.0 1.8 2.8 284 138 A 7 GLU HBy A 7 GLU HGx 1.0 1.8 2.8 285 139 A 7 GLU H A 7 GLU HA 1.0 1.8 4.5 286 140 A 7 GLU H A 7 GLU HBx 1.0 1.8 2.8 287 140 A 7 GLU H A 7 GLU HBy 1.0 1.8 2.8 288 141 A 7 GLU H A 7 GLU HGy 1.0 1.8 5.5 289 141 A 7 GLU H A 7 GLU HGx 1.0 1.8 5.5 290 142 A 8 GLN HA A 8 GLN HBx 1.0 1.8 3.5 291 142 A 8 GLN HA A 8 GLN HBy 1.0 1.8 3.5 292 143 A 8 GLN HA A 8 GLN HBx 1.0 1.8 2.8 293 143 A 8 GLN HA A 8 GLN HBy 1.0 1.8 2.8 294 144 A 8 GLN HA A 8 GLN HBx 1.0 1.8 2.8 295 144 A 8 GLN HA A 8 GLN HBy 1.0 1.8 2.8 296 145 A 8 GLN HA A 8 GLN HGx 1.0 1.8 4.5 297 145 A 8 GLN HA A 8 GLN HGy 1.0 1.8 4.5 298 146 A 8 GLN HA A 8 GLN HGx 1.0 1.8 2.8 299 146 A 8 GLN HA A 8 GLN HGy 1.0 1.8 2.8 300 147 A 8 GLN HA A 8 GLN HGx 1.0 1.8 3.5 301 147 A 8 GLN HA A 8 GLN HGy 1.0 1.8 3.5 302 148 A 8 GLN HBy A 8 GLN HGx 1.0 1.8 2.8 303 148 A 8 GLN HGy A 8 GLN HBx 1.0 1.8 2.8 304 148 A 8 GLN HBy A 8 GLN HGy 1.0 1.8 2.8 305 148 A 8 GLN HBx A 8 GLN HGx 1.0 1.8 2.8 306 149 A 8 GLN HBx A 8 GLN HGx 1.0 1.8 2.8 307 149 A 8 GLN HGy A 8 GLN HBx 1.0 1.8 2.8 308 149 A 8 GLN HBy A 8 GLN HGy 1.0 1.8 2.8 309 149 A 8 GLN HBy A 8 GLN HGx 1.0 1.8 2.8 310 150 A 8 GLN H A 8 GLN HBx 1.0 1.8 3.5 311 150 A 8 GLN HBy A 8 GLN H 1.0 1.8 3.5 312 151 A 8 GLN H A 8 GLN HBx 1.0 1.8 3.5 313 151 A 8 GLN HBy A 8 GLN H 1.0 1.8 3.5 314 152 A 8 GLN H A 8 GLN HGx 1.0 1.8 5.5 315 152 A 8 GLN HGy A 8 GLN H 1.0 1.8 5.5 316 153 A 8 GLN H A 8 GLN HGx 1.0 1.8 4.5 317 153 A 8 GLN HGy A 8 GLN H 1.0 1.8 4.5 318 154 A 6 PRO HA A 9 VAL HB 1.0 1.8 3.5 319 155 A 9 VAL HB A 6 PRO HDy 1.0 1.8 5.5 320 155 A 6 PRO HDx A 9 VAL HB 1.0 1.8 5.5 321 156 A 6 PRO HBy A 9 VAL HGx% 1.0 1.8 4.5 322 156 A 6 PRO HBx A 9 VAL HGx% 1.0 1.8 4.5 323 156 A 9 VAL HGy% A 6 PRO HBy 1.0 1.8 4.5 324 156 A 6 PRO HBx A 9 VAL HGy% 1.0 1.8 4.5 325 157 A 6 PRO HBy A 9 VAL HGx% 1.0 1.8 4.5 326 157 A 6 PRO HBx A 9 VAL HGx% 1.0 1.8 4.5 327 157 A 9 VAL HGy% A 6 PRO HBy 1.0 1.8 4.5 328 157 A 6 PRO HBx A 9 VAL HGy% 1.0 1.8 4.5 329 158 A 9 VAL HGy% A 6 PRO HBy 1.0 1.8 3.5 330 158 A 6 PRO HBx A 9 VAL HGy% 1.0 1.8 3.5 331 159 A 6 PRO HDx A 9 VAL HGy% 1.0 1.8 4.5 332 159 A 9 VAL HGy% A 6 PRO HDy 1.0 1.8 4.5 333 160 A 6 PRO HGy A 9 VAL HGx% 1.0 1.8 4.5 334 160 A 6 PRO HGx A 9 VAL HGx% 1.0 1.8 4.5 335 160 A 9 VAL HGy% A 6 PRO HGx 1.0 1.8 4.5 336 160 A 6 PRO HGy A 9 VAL HGy% 1.0 1.8 4.5 337 161 A 6 PRO HGy A 9 VAL HGx% 1.0 1.8 4.5 338 161 A 6 PRO HGx A 9 VAL HGx% 1.0 1.8 4.5 339 161 A 9 VAL HGy% A 6 PRO HGx 1.0 1.8 4.5 340 161 A 6 PRO HGy A 9 VAL HGy% 1.0 1.8 4.5 341 162 A 6 PRO HGy A 9 VAL HGy% 1.0 1.8 3.5 342 162 A 9 VAL HGy% A 6 PRO HGx 1.0 1.8 3.5 343 163 A 9 VAL H A 6 PRO HBy 1.0 1.8 5.5 344 163 A 9 VAL H A 6 PRO HBx 1.0 1.8 5.5 345 164 A 9 VAL H A 8 GLN HA 1.0 1.8 4.5 346 165 A 9 VAL H A 8 GLN HBx 1.0 1.8 3.5 347 165 A 9 VAL H A 8 GLN HBy 1.0 1.8 3.5 348 166 A 9 VAL H A 8 GLN HBx 1.0 1.8 4.5 349 166 A 9 VAL H A 8 GLN HBy 1.0 1.8 4.5 350 167 A 9 VAL HB A 9 VAL HA 1.0 1.8 3.5 351 168 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 2.8 352 169 A 9 VAL HB A 9 VAL HGx% 1.0 1.8 2.8 353 170 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 2.8 354 170 A 9 VAL HGy% A 9 VAL HA 1.0 1.8 2.8 355 171 A 9 VAL HGy% A 9 VAL HA 1.0 1.8 2.8 356 172 A 9 VAL HB A 9 VAL HGx% 1.0 1.8 2.8 357 172 A 9 VAL HB A 9 VAL HGy% 1.0 1.8 2.8 358 173 A 9 VAL HB A 9 VAL HGy% 1.0 1.8 2.8 359 174 A 9 VAL H A 9 VAL HB 1.0 1.8 2.8 360 175 A 9 VAL H A 9 VAL HGy% 1.0 1.8 2.8 361 176 A 7 GLU HA A 10 ASP HBx 1.0 1.8 2.8 362 176 A 7 GLU HA A 10 ASP HBy 1.0 1.8 2.8 363 177 A 7 GLU HBy A 10 ASP HBx 1.0 1.8 4.5 364 177 A 7 GLU HBx A 10 ASP HBx 1.0 1.8 4.5 365 177 A 10 ASP HBy A 7 GLU HBx 1.0 1.8 4.5 366 177 A 7 GLU HBy A 10 ASP HBy 1.0 1.8 4.5 367 178 A 10 ASP H A 7 GLU HA 1.0 1.8 5.5 368 179 A 10 ASP HA A 9 VAL HGx% 1.0 1.8 3.5 369 180 A 10 ASP HBy A 9 VAL HGx% 1.0 1.8 3.5 370 180 A 9 VAL HGx% A 10 ASP HBx 1.0 1.8 3.5 371 181 A 10 ASP H A 9 VAL HB 1.0 1.8 2.8 372 182 A 10 ASP H A 9 VAL HGy% 1.0 1.8 4.5 373 183 A 10 ASP HA A 10 ASP HBx 1.0 1.8 2.8 374 183 A 10 ASP HBy A 10 ASP HA 1.0 1.8 2.8 375 184 A 10 ASP H A 10 ASP HBx 1.0 1.8 2.8 376 184 A 10 ASP H A 10 ASP HBy 1.0 1.8 2.8 377 185 A 8 GLN HA A 11 LYS HBy 1.0 1.8 4.5 378 185 A 8 GLN HA A 11 LYS HBx 1.0 1.8 4.5 379 186 A 8 GLN HA A 11 LYS HBy 1.0 1.8 3.5 380 186 A 8 GLN HA A 11 LYS HBx 1.0 1.8 3.5 381 187 A 8 GLN HA A 11 LYS HDy 1.0 1.8 5.5 382 187 A 8 GLN HA A 11 LYS HDx 1.0 1.8 5.5 383 188 A 8 GLN HA A 11 LYS HDy 1.0 1.8 3.5 384 188 A 8 GLN HA A 11 LYS HDx 1.0 1.8 3.5 385 189 A 8 GLN HA A 11 LYS HGy 1.0 1.8 5.5 386 189 A 8 GLN HA A 11 LYS HGx 1.0 1.8 5.5 387 190 A 8 GLN HA A 11 LYS HGy 1.0 1.8 4.5 388 190 A 8 GLN HA A 11 LYS HGx 1.0 1.8 4.5 389 191 A 8 GLN HA A 11 LYS HGy 1.0 1.8 5.5 390 191 A 8 GLN HA A 11 LYS HGx 1.0 1.8 5.5 391 192 A 11 LYS H A 10 ASP HBx 1.0 1.8 3.5 392 192 A 10 ASP HBy A 11 LYS H 1.0 1.8 3.5 393 193 A 11 LYS HA A 11 LYS HBy 1.0 1.8 2.8 394 193 A 11 LYS HBx A 11 LYS HA 1.0 1.8 2.8 395 194 A 11 LYS HA A 11 LYS HBy 1.0 1.8 2.8 396 194 A 11 LYS HBx A 11 LYS HA 1.0 1.8 2.8 397 195 A 11 LYS HA A 11 LYS HDy 1.0 1.8 4.5 398 195 A 11 LYS HDx A 11 LYS HA 1.0 1.8 4.5 399 196 A 11 LYS HA A 11 LYS HDy 1.0 1.8 3.5 400 196 A 11 LYS HDx A 11 LYS HA 1.0 1.8 3.5 401 197 A 11 LYS HDx A 11 LYS HEx 1.0 1.8 2.8 402 197 A 11 LYS HDy A 11 LYS HEx 1.0 1.8 2.8 403 197 A 11 LYS HEy A 11 LYS HDy 1.0 1.8 2.8 404 197 A 11 LYS HDx A 11 LYS HEy 1.0 1.8 2.8 405 198 A 11 LYS HDx A 11 LYS HEx 1.0 1.8 2.8 406 198 A 11 LYS HDy A 11 LYS HEx 1.0 1.8 2.8 407 198 A 11 LYS HEy A 11 LYS HDy 1.0 1.8 2.8 408 198 A 11 LYS HDx A 11 LYS HEy 1.0 1.8 2.8 409 199 A 11 LYS HA A 11 LYS HGy 1.0 1.8 4.5 410 199 A 11 LYS HGx A 11 LYS HA 1.0 1.8 4.5 411 200 A 11 LYS HA A 11 LYS HGy 1.0 1.8 3.5 412 200 A 11 LYS HGx A 11 LYS HA 1.0 1.8 3.5 413 201 A 11 LYS HA A 11 LYS HGy 1.0 1.8 4.5 414 201 A 11 LYS HGx A 11 LYS HA 1.0 1.8 4.5 415 202 A 11 LYS HA A 11 LYS HGy 1.0 1.8 3.5 416 202 A 11 LYS HGx A 11 LYS HA 1.0 1.8 3.5 417 203 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 2.8 418 203 A 11 LYS HGx A 11 LYS HBy 1.0 1.8 2.8 419 203 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 2.8 420 203 A 11 LYS HBy A 11 LYS HGy 1.0 1.8 2.8 421 204 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 2.8 422 204 A 11 LYS HGx A 11 LYS HBy 1.0 1.8 2.8 423 204 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 2.8 424 204 A 11 LYS HBy A 11 LYS HGy 1.0 1.8 2.8 425 205 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 2.8 426 205 A 11 LYS HGx A 11 LYS HBy 1.0 1.8 2.8 427 205 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 2.8 428 205 A 11 LYS HBy A 11 LYS HGy 1.0 1.8 2.8 429 206 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 3.5 430 206 A 11 LYS HGx A 11 LYS HBy 1.0 1.8 3.5 431 206 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 3.5 432 206 A 11 LYS HBy A 11 LYS HGy 1.0 1.8 3.5 433 207 A 11 LYS HEx A 11 LYS HGy 1.0 1.8 4.5 434 207 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 4.5 435 207 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 4.5 436 207 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 4.5 437 208 A 11 LYS HEx A 11 LYS HGy 1.0 1.8 4.5 438 208 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 4.5 439 208 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 4.5 440 208 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 4.5 441 209 A 11 LYS HEx A 11 LYS HGy 1.0 1.8 3.5 442 209 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 3.5 443 209 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 3.5 444 209 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 3.5 445 210 A 11 LYS HEx A 11 LYS HGy 1.0 1.8 3.5 446 210 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 3.5 447 210 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 3.5 448 210 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 3.5 449 211 A 11 LYS H A 11 LYS HA 1.0 1.8 3.5 450 212 A 11 LYS H A 11 LYS HBy 1.0 1.8 2.8 451 212 A 11 LYS HBx A 11 LYS H 1.0 1.8 2.8 452 213 A 11 LYS H A 11 LYS HGy 1.0 1.8 4.5 453 213 A 11 LYS HGx A 11 LYS H 1.0 1.8 4.5 454 214 A 11 LYS H A 11 LYS HGy 1.0 1.8 4.5 455 214 A 11 LYS HGx A 11 LYS H 1.0 1.8 4.5 456 215 A 12 LEU HDy% A 8 GLN HBx 1.0 1.8 4.5 457 215 A 8 GLN HBy A 12 LEU HDy% 1.0 1.8 4.5 458 216 A 8 GLN HBy A 12 LEU HDy% 1.0 1.8 4.5 459 216 A 12 LEU HDy% A 8 GLN HBx 1.0 1.8 4.5 460 217 A 8 GLN HBy A 12 LEU HDy% 1.0 1.8 2.8 461 217 A 12 LEU HDy% A 8 GLN HBx 1.0 1.8 2.8 462 218 A 9 VAL HA A 12 LEU HB3 1.0 1.8 3.5 463 219 A 9 VAL HA A 12 LEU HB2 1.0 1.8 3.5 464 220 A 9 VAL HA A 12 LEU HG 1.0 1.8 4.5 465 221 A 11 LYS HBy A 12 LEU HDx% 1.0 1.8 4.5 466 221 A 11 LYS HBx A 12 LEU HDx% 1.0 1.8 4.5 467 221 A 12 LEU HDy% A 11 LYS HBy 1.0 1.8 4.5 468 221 A 11 LYS HBx A 12 LEU HDy% 1.0 1.8 4.5 469 222 A 11 LYS HA A 12 LEU H 1.0 1.8 4.5 470 223 A 12 LEU H A 11 LYS HBy 1.0 1.8 3.5 471 223 A 11 LYS HBx A 12 LEU H 1.0 1.8 3.5 472 224 A 12 LEU HB3 A 12 LEU HA 1.0 1.8 3.5 473 225 A 12 LEU HB3 A 12 LEU HA 1.0 1.8 2.8 474 226 A 12 LEU HB2 A 12 LEU HA 1.0 1.8 3.5 475 227 A 12 LEU HB2 A 12 LEU HA 1.0 1.8 2.8 476 228 A 12 LEU HA A 12 LEU HDx% 1.0 1.8 3.5 477 229 A 12 LEU HA A 12 LEU HDx% 1.0 1.8 2.8 478 230 A 12 LEU HB2 A 12 LEU HDx% 1.0 1.8 3.5 479 231 A 12 LEU HDy% A 12 LEU HA 1.0 1.8 2.8 480 232 A 12 LEU HB3 A 12 LEU HDx% 1.0 1.8 2.8 481 232 A 12 LEU HB3 A 12 LEU HDy% 1.0 1.8 2.8 482 233 A 12 LEU HB2 A 12 LEU HDx% 1.0 1.8 2.8 483 233 A 12 LEU HB2 A 12 LEU HDy% 1.0 1.8 2.8 484 234 A 12 LEU HB2 A 12 LEU HDy% 1.0 1.8 2.8 485 235 A 12 LEU HG A 12 LEU HA 1.0 1.8 4.5 486 236 A 12 LEU HB2 A 12 LEU HG 1.0 1.8 2.8 487 237 A 12 LEU HG A 12 LEU HDx% 1.0 1.8 2.8 488 238 A 12 LEU HG A 12 LEU HDx% 1.0 1.8 2.8 489 238 A 12 LEU HG A 12 LEU HDy% 1.0 1.8 2.8 490 239 A 12 LEU HG A 12 LEU HDy% 1.0 1.8 2.8 491 240 A 12 LEU H A 12 LEU HA 1.0 1.8 4.5 492 241 A 12 LEU HB3 A 12 LEU H 1.0 1.8 3.5 493 242 A 12 LEU HB2 A 12 LEU H 1.0 1.8 2.8 494 243 A 12 LEU HDy% A 12 LEU H 1.0 1.8 2.8 495 244 A 12 LEU HG A 12 LEU H 1.0 1.8 3.5 496 245 A 13 ILE HB A 10 ASP HA 1.0 1.8 3.5 497 246 A 13 ILE HD1% A 10 ASP HA 1.0 1.8 3.5 498 247 A 13 ILE HG1x A 10 ASP HA 1.0 1.8 5.5 499 248 A 13 ILE HG2% A 10 ASP HA 1.0 1.8 3.5 500 249 A 13 ILE H A 12 LEU HA 1.0 1.8 4.5 501 250 A 13 ILE H A 12 LEU HB3 1.0 1.8 3.5 502 251 A 13 ILE H A 12 LEU HB2 1.0 1.8 3.5 503 252 A 13 ILE H A 12 LEU HDy% 1.0 1.8 4.5 504 253 A 13 ILE HA A 13 ILE HB 1.0 1.8 3.5 505 254 A 13 ILE HD1% A 13 ILE HB 1.0 1.8 2.8 506 255 A 13 ILE HG1x A 13 ILE HA 1.0 1.8 4.5 507 256 A 13 ILE HG1x A 13 ILE HB 1.0 1.8 2.8 508 257 A 13 ILE HG1x A 13 ILE HB 1.0 1.8 3.5 509 258 A 13 ILE HG1x A 13 ILE HD1% 1.0 1.8 2.8 510 259 A 13 ILE HG1y A 13 ILE HA 1.0 1.8 3.5 511 260 A 13 ILE HG1y A 13 ILE HB 1.0 1.8 3.5 512 261 A 13 ILE HG1y A 13 ILE HB 1.0 1.8 4.5 513 262 A 13 ILE HD1% A 13 ILE HG1y 1.0 1.8 2.8 514 263 A 13 ILE HG2% A 13 ILE HA 1.0 1.8 2.8 515 264 A 13 ILE HG2% A 13 ILE HB 1.0 1.8 2.8 516 265 A 13 ILE HG2% A 13 ILE HB 1.0 1.8 2.8 517 266 A 13 ILE HG1x A 13 ILE HG2% 1.0 1.8 3.5 518 267 A 13 ILE HG2% A 13 ILE HG1y 1.0 1.8 2.8 519 268 A 13 ILE H A 13 ILE HD1% 1.0 1.8 3.5 520 269 A 11 LYS HA A 14 GLN HB2 1.0 1.8 4.5 521 270 A 14 GLN H A 11 LYS HA 1.0 1.8 5.5 522 271 A 13 ILE HG2% A 14 GLN HA 1.0 1.8 3.5 523 272 A 14 GLN HA A 14 GLN HB3 1.0 1.8 3.5 524 273 A 14 GLN HA A 14 GLN HB3 1.0 1.8 2.8 525 274 A 14 GLN HB2 A 14 GLN HA 1.0 1.8 4.5 526 275 A 14 GLN HB2 A 14 GLN HA 1.0 1.8 2.8 527 276 A 14 GLN HA A 14 GLN HGy 1.0 1.8 4.5 528 276 A 14 GLN HA A 14 GLN HGx 1.0 1.8 4.5 529 277 A 14 GLN HA A 14 GLN HGy 1.0 1.8 3.5 530 277 A 14 GLN HA A 14 GLN HGx 1.0 1.8 3.5 531 278 A 14 GLN HA A 14 GLN HGy 1.0 1.8 2.8 532 278 A 14 GLN HA A 14 GLN HGx 1.0 1.8 2.8 533 279 A 14 GLN HB3 A 14 GLN HGy 1.0 1.8 2.8 534 279 A 14 GLN HB3 A 14 GLN HGx 1.0 1.8 2.8 535 280 A 14 GLN HB2 A 14 GLN HGy 1.0 1.8 2.8 536 280 A 14 GLN HB2 A 14 GLN HGx 1.0 1.8 2.8 537 281 A 14 GLN HE2x A 14 GLN HGy 1.0 1.8 4.5 538 281 A 14 GLN HE2y A 14 GLN HGy 1.0 1.8 4.5 539 281 A 14 GLN HGx A 14 GLN HE2x 1.0 1.8 4.5 540 281 A 14 GLN HGx A 14 GLN HE2y 1.0 1.8 4.5 541 282 A 14 GLN HE2x A 14 GLN HGy 1.0 1.8 4.5 542 282 A 14 GLN HE2y A 14 GLN HGy 1.0 1.8 4.5 543 282 A 14 GLN HGx A 14 GLN HE2x 1.0 1.8 4.5 544 282 A 14 GLN HGx A 14 GLN HE2y 1.0 1.8 4.5 545 283 A 14 GLN H A 14 GLN HA 1.0 1.8 3.5 546 284 A 14 GLN H A 14 GLN HB3 1.0 1.8 3.5 547 285 A 14 GLN H A 14 GLN HB2 1.0 1.8 2.8 548 286 A 14 GLN H A 14 GLN HGy 1.0 1.8 3.5 549 286 A 14 GLN H A 14 GLN HGx 1.0 1.8 3.5 550 287 A 14 GLN H A 14 GLN HGy 1.0 1.8 3.5 551 287 A 14 GLN H A 14 GLN HGx 1.0 1.8 3.5 552 288 A 12 LEU HA A 15 GLN HB3 1.0 1.8 3.5 553 289 A 12 LEU HA A 15 GLN HB2 1.0 1.8 4.5 554 290 A 12 LEU HA A 15 GLN H 1.0 1.8 5.5 555 291 A 15 GLN HB3 A 15 GLN HA 1.0 1.8 2.8 556 292 A 15 GLN HB2 A 15 GLN HA 1.0 1.8 3.5 557 293 A 15 GLN HA A 15 GLN HGx 1.0 1.8 2.8 558 293 A 15 GLN HA A 15 GLN HGy 1.0 1.8 2.8 559 294 A 15 GLN HB3 A 15 GLN HGx 1.0 1.8 2.8 560 294 A 15 GLN HB3 A 15 GLN HGy 1.0 1.8 2.8 561 295 A 15 GLN HB3 A 15 GLN HGx 1.0 1.8 2.8 562 295 A 15 GLN HB3 A 15 GLN HGy 1.0 1.8 2.8 563 296 A 15 GLN HB2 A 15 GLN HGx 1.0 1.8 2.8 564 296 A 15 GLN HB2 A 15 GLN HGy 1.0 1.8 2.8 565 297 A 15 GLN HB2 A 15 GLN HGx 1.0 1.8 2.8 566 297 A 15 GLN HB2 A 15 GLN HGy 1.0 1.8 2.8 567 298 A 15 GLN HE2x A 15 GLN HGx 1.0 1.8 4.5 568 298 A 15 GLN HE2y A 15 GLN HGx 1.0 1.8 4.5 569 298 A 15 GLN HGy A 15 GLN HE2x 1.0 1.8 4.5 570 298 A 15 GLN HGy A 15 GLN HE2y 1.0 1.8 4.5 571 299 A 15 GLN HE2x A 15 GLN HGx 1.0 1.8 3.5 572 299 A 15 GLN HE2y A 15 GLN HGx 1.0 1.8 3.5 573 299 A 15 GLN HGy A 15 GLN HE2x 1.0 1.8 3.5 574 299 A 15 GLN HGy A 15 GLN HE2y 1.0 1.8 3.5 575 300 A 15 GLN HB3 A 15 GLN H 1.0 1.8 3.5 576 301 A 15 GLN HB2 A 15 GLN H 1.0 1.8 3.5 577 302 A 15 GLN H A 15 GLN HGx 1.0 1.8 3.5 578 302 A 15 GLN H A 15 GLN HGy 1.0 1.8 3.5 579 303 A 13 ILE HA A 16 ALA HB% 1.0 1.8 2.8 580 304 A 16 ALA HB% A 15 GLN HB2 1.0 1.8 4.5 581 305 A 16 ALA HB% A 15 GLN HB2 1.0 1.8 4.5 582 306 A 16 ALA H A 15 GLN HB2 1.0 1.8 3.5 583 307 A 16 ALA HB% A 16 ALA HA 1.0 1.8 2.8 584 308 A 17 THR HA A 17 THR HG2% 1.0 1.8 2.8 585 309 A 17 THR HB A 17 THR HG2% 1.0 1.8 2.8 586 310 A 18 SER HB3 A 18 SER HA 1.0 1.8 2.8 587 311 A 18 SER HA A 18 SER HB2 1.0 1.8 3.5 588 312 A 18 SER H A 18 SER HB3 1.0 1.8 4.5 589 313 A 18 SER H A 18 SER HB2 1.0 1.8 4.5 590 314 A 19 ILE HB A 16 ALA HA 1.0 1.8 4.5 591 315 A 19 ILE HD1% A 16 ALA HA 1.0 1.8 4.5 592 316 A 18 SER HB3 A 19 ILE H 1.0 1.8 4.5 593 317 A 18 SER HB2 A 19 ILE H 1.0 1.8 4.5 594 318 A 19 ILE HB A 19 ILE HA 1.0 1.8 3.5 595 319 A 19 ILE HD1% A 19 ILE HA 1.0 1.8 3.5 596 320 A 19 ILE HB A 19 ILE HD1% 1.0 1.8 2.8 597 321 A 19 ILE HG1x A 19 ILE HA 1.0 1.8 3.5 598 322 A 19 ILE HB A 19 ILE HG1x 1.0 1.8 2.8 599 323 A 19 ILE HB A 19 ILE HG1x 1.0 1.8 3.5 600 324 A 19 ILE HD1% A 19 ILE HG1x 1.0 1.8 2.8 601 325 A 19 ILE HD1% A 19 ILE HG1x 1.0 1.8 2.8 602 326 A 19 ILE HA A 19 ILE HG1y 1.0 1.8 3.5 603 327 A 19 ILE HB A 19 ILE HG1y 1.0 1.8 3.5 604 328 A 19 ILE HB A 19 ILE HG1y 1.0 1.8 4.5 605 329 A 19 ILE HD1% A 19 ILE HG1y 1.0 1.8 2.8 606 330 A 19 ILE HD1% A 19 ILE HG1y 1.0 1.8 2.8 607 331 A 19 ILE HG2% A 19 ILE HA 1.0 1.8 2.8 608 332 A 19 ILE HG2% A 19 ILE HB 1.0 1.8 2.8 609 333 A 19 ILE HG2% A 19 ILE HG1x 1.0 1.8 3.5 610 334 A 19 ILE HG2% A 19 ILE HG1x 1.0 1.8 3.5 611 335 A 19 ILE HG2% A 19 ILE HG1y 1.0 1.8 2.8 612 336 A 19 ILE HG2% A 19 ILE HG1y 1.0 1.8 2.8 613 337 A 19 ILE H A 19 ILE HA 1.0 1.8 3.5 614 338 A 19 ILE HB A 19 ILE H 1.0 1.8 2.8 615 339 A 19 ILE HD1% A 19 ILE H 1.0 1.8 5.5 616 340 A 19 ILE HG1x A 19 ILE H 1.0 1.8 3.5 617 341 A 19 ILE H A 19 ILE HG1y 1.0 1.8 3.5 618 342 A 19 ILE HG2% A 19 ILE H 1.0 1.8 3.5 619 343 A 19 ILE HA A 20 GLU H 1.0 1.8 4.5 620 344 A 19 ILE HB A 20 GLU H 1.0 1.8 3.5 621 345 A 19 ILE HG1y A 20 GLU H 1.0 1.8 5.5 622 346 A 19 ILE HG2% A 20 GLU H 1.0 1.8 3.5 623 347 A 20 GLU HA A 20 GLU HBx 1.0 1.8 5.5 624 347 A 20 GLU HBy A 20 GLU HA 1.0 1.8 5.5 625 348 A 20 GLU HA A 20 GLU HGy 1.0 1.8 4.5 626 348 A 20 GLU HA A 20 GLU HGx 1.0 1.8 4.5 627 349 A 20 GLU HBy A 20 GLU HGy 1.0 1.8 3.5 628 349 A 20 GLU HBx A 20 GLU HGy 1.0 1.8 3.5 629 349 A 20 GLU HGx A 20 GLU HBx 1.0 1.8 3.5 630 349 A 20 GLU HBy A 20 GLU HGx 1.0 1.8 3.5 631 350 A 20 GLU H A 20 GLU HGy 1.0 1.8 5.5 632 350 A 20 GLU H A 20 GLU HGx 1.0 1.8 5.5 633 351 A 18 SER HA A 21 ARG HBy 1.0 1.8 4.5 634 351 A 18 SER HA A 21 ARG HBx 1.0 1.8 4.5 635 352 A 21 ARG HA A 21 ARG HBy 1.0 1.8 2.8 636 352 A 21 ARG HA A 21 ARG HBx 1.0 1.8 2.8 637 353 A 21 ARG HA A 21 ARG HBy 1.0 1.8 2.8 638 353 A 21 ARG HA A 21 ARG HBx 1.0 1.8 2.8 639 354 A 21 ARG HA A 21 ARG HDx 1.0 1.8 3.5 640 354 A 21 ARG HA A 21 ARG HDy 1.0 1.8 3.5 641 355 A 21 ARG HA A 21 ARG HDx 1.0 1.8 4.5 642 355 A 21 ARG HA A 21 ARG HDy 1.0 1.8 4.5 643 356 A 21 ARG HBx A 21 ARG HDx 1.0 1.8 3.5 644 356 A 21 ARG HBy A 21 ARG HDx 1.0 1.8 3.5 645 356 A 21 ARG HDy A 21 ARG HBy 1.0 1.8 3.5 646 356 A 21 ARG HBx A 21 ARG HDy 1.0 1.8 3.5 647 357 A 21 ARG HBx A 21 ARG HDx 1.0 1.8 2.8 648 357 A 21 ARG HBy A 21 ARG HDx 1.0 1.8 2.8 649 357 A 21 ARG HDy A 21 ARG HBy 1.0 1.8 2.8 650 357 A 21 ARG HBx A 21 ARG HDy 1.0 1.8 2.8 651 358 A 21 ARG HDy A 21 ARG HGx 1.0 1.8 2.8 652 358 A 21 ARG HDx A 21 ARG HGx 1.0 1.8 2.8 653 359 A 21 ARG HA A 21 ARG HGx 1.0 1.8 3.5 654 359 A 21 ARG HA A 21 ARG HGy 1.0 1.8 3.5 655 360 A 21 ARG HA A 21 ARG HGx 1.0 1.8 4.5 656 360 A 21 ARG HA A 21 ARG HGy 1.0 1.8 4.5 657 361 A 21 ARG HA A 21 ARG HGx 1.0 1.8 3.5 658 361 A 21 ARG HA A 21 ARG HGy 1.0 1.8 3.5 659 362 A 21 ARG HA A 21 ARG HGx 1.0 1.8 3.5 660 362 A 21 ARG HA A 21 ARG HGy 1.0 1.8 3.5 661 363 A 21 ARG HBy A 21 ARG HGx 1.0 1.8 2.8 662 363 A 21 ARG HBx A 21 ARG HGx 1.0 1.8 2.8 663 363 A 21 ARG HGy A 21 ARG HBy 1.0 1.8 2.8 664 363 A 21 ARG HBx A 21 ARG HGy 1.0 1.8 2.8 665 364 A 21 ARG HBx A 21 ARG HGx 1.0 1.8 2.8 666 364 A 21 ARG HBy A 21 ARG HGx 1.0 1.8 2.8 667 364 A 21 ARG HGy A 21 ARG HBy 1.0 1.8 2.8 668 364 A 21 ARG HBx A 21 ARG HGy 1.0 1.8 2.8 669 365 A 21 ARG HBx A 21 ARG HGx 1.0 1.8 2.8 670 365 A 21 ARG HBy A 21 ARG HGx 1.0 1.8 2.8 671 365 A 21 ARG HGy A 21 ARG HBy 1.0 1.8 2.8 672 365 A 21 ARG HBx A 21 ARG HGy 1.0 1.8 2.8 673 366 A 21 ARG HBx A 21 ARG HGx 1.0 1.8 2.8 674 366 A 21 ARG HBy A 21 ARG HGx 1.0 1.8 2.8 675 366 A 21 ARG HGy A 21 ARG HBy 1.0 1.8 2.8 676 366 A 21 ARG HBx A 21 ARG HGy 1.0 1.8 2.8 677 367 A 21 ARG HGy A 21 ARG HDx 1.0 1.8 2.8 678 367 A 21 ARG HDy A 21 ARG HGy 1.0 1.8 2.8 679 368 A 21 ARG HDy A 21 ARG HGx 1.0 1.8 2.8 680 368 A 21 ARG HDx A 21 ARG HGx 1.0 1.8 2.8 681 368 A 21 ARG HGy A 21 ARG HDx 1.0 1.8 2.8 682 368 A 21 ARG HDy A 21 ARG HGy 1.0 1.8 2.8 683 369 A 21 ARG HDy A 21 ARG HGx 1.0 1.8 2.8 684 369 A 21 ARG HDx A 21 ARG HGx 1.0 1.8 2.8 685 369 A 21 ARG HGy A 21 ARG HDx 1.0 1.8 2.8 686 369 A 21 ARG HDy A 21 ARG HGy 1.0 1.8 2.8 687 370 A 21 ARG HA A 21 ARG H 1.0 1.8 3.5 688 371 A 21 ARG H A 21 ARG HBy 1.0 1.8 2.8 689 371 A 21 ARG HBx A 21 ARG H 1.0 1.8 2.8 690 372 A 21 ARG H A 21 ARG HDx 1.0 1.8 5.5 691 372 A 21 ARG HDy A 21 ARG H 1.0 1.8 5.5 692 373 A 21 ARG H A 21 ARG HGx 1.0 1.8 4.5 693 373 A 21 ARG HGy A 21 ARG H 1.0 1.8 4.5 694 374 A 21 ARG H A 21 ARG HGx 1.0 1.8 4.5 695 374 A 21 ARG HGy A 21 ARG H 1.0 1.8 4.5 696 375 A 22 LEU HB3 A 19 ILE HA 1.0 1.8 3.5 697 376 A 19 ILE HA A 22 LEU HB2 1.0 1.8 3.5 698 377 A 22 LEU HDy% A 19 ILE HA 1.0 1.8 3.5 699 378 A 22 LEU HG A 19 ILE HA 1.0 1.8 5.5 700 379 A 22 LEU HA A 21 ARG HBy 1.0 1.8 5.5 701 379 A 22 LEU HA A 21 ARG HBx 1.0 1.8 5.5 702 380 A 21 ARG HBy A 22 LEU HDx% 1.0 1.8 5.5 703 380 A 21 ARG HBx A 22 LEU HDx% 1.0 1.8 5.5 704 381 A 21 ARG HA A 22 LEU H 1.0 1.8 4.5 705 382 A 22 LEU H A 21 ARG HBy 1.0 1.8 3.5 706 382 A 22 LEU H A 21 ARG HBx 1.0 1.8 3.5 707 383 A 22 LEU H A 21 ARG HGx 1.0 1.8 5.5 708 383 A 22 LEU H A 21 ARG HGy 1.0 1.8 5.5 709 384 A 22 LEU HA A 22 LEU HB3 1.0 1.8 2.8 710 385 A 22 LEU HA A 22 LEU HB2 1.0 1.8 2.8 711 386 A 22 LEU HA A 22 LEU HDx% 1.0 1.8 2.8 712 387 A 22 LEU HB2 A 22 LEU HDx% 1.0 1.8 3.5 713 388 A 22 LEU HA A 22 LEU HDy% 1.0 1.8 3.5 714 389 A 22 LEU HB3 A 22 LEU HDx% 1.0 1.8 2.8 715 389 A 22 LEU HB3 A 22 LEU HDy% 1.0 1.8 2.8 716 390 A 22 LEU HB3 A 22 LEU HDy% 1.0 1.8 2.8 717 391 A 22 LEU HB2 A 22 LEU HDx% 1.0 1.8 2.8 718 391 A 22 LEU HDy% A 22 LEU HB2 1.0 1.8 2.8 719 392 A 22 LEU HDy% A 22 LEU HB2 1.0 1.8 2.8 720 393 A 22 LEU HA A 22 LEU HG 1.0 1.8 4.5 721 394 A 22 LEU HB3 A 22 LEU HG 1.0 1.8 3.5 722 395 A 22 LEU HG A 22 LEU HB2 1.0 1.8 2.8 723 396 A 22 LEU HG A 22 LEU HDx% 1.0 1.8 2.8 724 397 A 22 LEU HG A 22 LEU HDx% 1.0 1.8 2.8 725 398 A 22 LEU HB3 A 22 LEU H 1.0 1.8 3.5 726 399 A 22 LEU H A 22 LEU HB2 1.0 1.8 2.8 727 400 A 22 LEU H A 22 LEU HDx% 1.0 1.8 4.5 728 401 A 22 LEU HG A 22 LEU H 1.0 1.8 3.5 729 402 A 22 LEU HB3 A 23 CYS H 1.0 1.8 4.5 730 403 A 22 LEU HB2 A 23 CYS H 1.0 1.8 3.5 731 404 A 23 CYS HA A 23 CYS HBx 1.0 1.8 4.5 732 404 A 23 CYS HA A 23 CYS HBy 1.0 1.8 4.5 733 405 A 23 CYS HA A 23 CYS HBx 1.0 1.8 4.5 734 405 A 23 CYS HA A 23 CYS HBy 1.0 1.8 4.5 735 406 A 23 CYS HA A 23 CYS HBx 1.0 1.8 3.5 736 406 A 23 CYS HA A 23 CYS HBy 1.0 1.8 3.5 737 407 A 23 CYS HA A 23 CYS HBx 1.0 1.8 3.5 738 407 A 23 CYS HA A 23 CYS HBy 1.0 1.8 3.5 739 408 A 23 CYS H A 23 CYS HA 1.0 1.8 4.5 740 409 A 23 CYS H A 23 CYS HBx 1.0 1.8 3.5 741 409 A 23 CYS H A 23 CYS HBy 1.0 1.8 3.5 742 410 A 23 CYS H A 23 CYS HBx 1.0 1.8 3.5 743 410 A 23 CYS H A 23 CYS HBy 1.0 1.8 3.5 744 411 A 20 GLU HGx A 24 GLN HGy 1.0 1.8 4.5 745 411 A 20 GLU HGy A 24 GLN HGy 1.0 1.8 4.5 746 411 A 24 GLN HGx A 20 GLU HGy 1.0 1.8 4.5 747 411 A 20 GLU HGx A 24 GLN HGx 1.0 1.8 4.5 748 412 A 20 GLU HGx A 24 GLN HGy 1.0 1.8 5.5 749 412 A 20 GLU HGy A 24 GLN HGy 1.0 1.8 5.5 750 412 A 24 GLN HGx A 20 GLU HGy 1.0 1.8 5.5 751 412 A 20 GLU HGx A 24 GLN HGx 1.0 1.8 5.5 752 413 A 21 ARG HA A 24 GLN HBy 1.0 1.8 3.5 753 413 A 24 GLN HBx A 21 ARG HA 1.0 1.8 3.5 754 414 A 21 ARG HA A 24 GLN HGy 1.0 1.8 5.5 755 414 A 21 ARG HA A 24 GLN HGx 1.0 1.8 5.5 756 415 A 21 ARG HA A 24 GLN H 1.0 1.8 4.5 757 416 A 24 GLN H A 23 CYS HBx 1.0 1.8 5.5 758 416 A 23 CYS HBy A 24 GLN H 1.0 1.8 5.5 759 417 A 24 GLN H A 23 CYS HBx 1.0 1.8 5.5 760 417 A 23 CYS HBy A 24 GLN H 1.0 1.8 5.5 761 418 A 24 GLN HA A 24 GLN HBy 1.0 1.8 2.8 762 418 A 24 GLN HBx A 24 GLN HA 1.0 1.8 2.8 763 419 A 24 GLN HA A 24 GLN HGy 1.0 1.8 4.5 764 419 A 24 GLN HA A 24 GLN HGx 1.0 1.8 4.5 765 420 A 24 GLN HA A 24 GLN HGy 1.0 1.8 3.5 766 420 A 24 GLN HA A 24 GLN HGx 1.0 1.8 3.5 767 421 A 24 GLN HA A 24 GLN HGy 1.0 1.8 3.5 768 421 A 24 GLN HA A 24 GLN HGx 1.0 1.8 3.5 769 422 A 24 GLN HA A 24 GLN HGy 1.0 1.8 3.5 770 422 A 24 GLN HA A 24 GLN HGx 1.0 1.8 3.5 771 423 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 3.5 772 423 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 3.5 773 423 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 3.5 774 423 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 3.5 775 424 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 3.5 776 424 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 3.5 777 424 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 3.5 778 424 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 3.5 779 425 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 3.5 780 425 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 3.5 781 425 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 3.5 782 425 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 3.5 783 426 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 2.8 784 426 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 2.8 785 426 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 2.8 786 426 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 2.8 787 427 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 2.8 788 427 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 2.8 789 427 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 2.8 790 427 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 2.8 791 428 A 24 GLN HBx A 24 GLN HGy 1.0 1.8 3.5 792 428 A 24 GLN HBy A 24 GLN HGy 1.0 1.8 3.5 793 428 A 24 GLN HGx A 24 GLN HBy 1.0 1.8 3.5 794 428 A 24 GLN HBx A 24 GLN HGx 1.0 1.8 3.5 795 429 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 4.5 796 429 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 4.5 797 429 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 4.5 798 429 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 4.5 799 430 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 4.5 800 430 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 4.5 801 430 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 4.5 802 430 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 4.5 803 431 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 5.5 804 431 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 5.5 805 431 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 5.5 806 431 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 5.5 807 432 A 24 GLN HA A 24 GLN H 1.0 1.8 4.5 808 433 A 24 GLN H A 24 GLN HBy 1.0 1.8 3.5 809 433 A 24 GLN HBx A 24 GLN H 1.0 1.8 3.5 810 434 A 24 GLN H A 24 GLN HBy 1.0 1.8 3.5 811 434 A 24 GLN HBx A 24 GLN H 1.0 1.8 3.5 812 435 A 24 GLN H A 24 GLN HGy 1.0 1.8 4.5 813 435 A 24 GLN HGx A 24 GLN H 1.0 1.8 4.5 814 436 A 24 GLN H A 24 GLN HGy 1.0 1.8 4.5 815 436 A 24 GLN HGx A 24 GLN H 1.0 1.8 4.5 816 437 A 24 GLN HA A 25 HIS H 1.0 1.8 4.5 817 438 A 25 HIS H A 24 GLN HBy 1.0 1.8 4.5 818 438 A 24 GLN HBx A 25 HIS H 1.0 1.8 4.5 819 439 A 25 HIS H A 24 GLN HBy 1.0 1.8 4.5 820 439 A 24 GLN HBx A 25 HIS H 1.0 1.8 4.5 821 440 A 25 HIS HB3 A 25 HIS H 1.0 1.8 3.5 822 441 A 25 HIS HB2 A 25 HIS H 1.0 1.8 3.5 823 442 A 26 TYR HD% A 22 LEU HB3 1.0 1.8 4.5 824 443 A 26 TYR HD% A 22 LEU HB2 1.0 1.8 5.5 825 444 A 26 TYR HD% A 22 LEU HDy% 1.0 1.8 4.5 826 445 A 26 TYR HE% A 22 LEU HDx% 1.0 1.8 2.8 827 446 A 26 TYR HD% A 25 HIS HB3 1.0 1.8 4.5 828 447 A 26 TYR HD% A 25 HIS HB2 1.0 1.8 5.5 829 448 A 25 HIS HB3 A 26 TYR H 1.0 1.8 3.5 830 449 A 25 HIS HB2 A 26 TYR H 1.0 1.8 4.5 831 450 A 26 TYR HB3 A 26 TYR HA 1.0 1.8 3.5 832 451 A 26 TYR HB2 A 26 TYR HA 1.0 1.8 3.5 833 452 A 26 TYR HD% A 26 TYR HB3 1.0 1.8 3.5 834 453 A 26 TYR HD% A 26 TYR HB2 1.0 1.8 3.5 835 454 A 26 TYR HB3 A 26 TYR H 1.0 1.8 3.5 836 455 A 26 TYR HB2 A 26 TYR H 1.0 1.8 3.5 837 456 A 23 CYS HA A 27 ILE HB 1.0 1.8 4.5 838 457 A 23 CYS HA A 27 ILE HD1% 1.0 1.8 3.5 839 458 A 23 CYS HA A 27 ILE HG1x 1.0 1.8 4.5 840 459 A 23 CYS HA A 27 ILE HG1y 1.0 1.8 4.5 841 460 A 26 TYR HB3 A 27 ILE HD1% 1.0 1.8 5.5 842 461 A 26 TYR HB2 A 27 ILE HD1% 1.0 1.8 5.5 843 462 A 26 TYR H A 27 ILE HD1% 1.0 1.8 4.5 844 463 A 26 TYR HB2 A 27 ILE HG1x 1.0 1.8 5.5 845 464 A 27 ILE HB A 27 ILE HA 1.0 1.8 4.5 846 465 A 27 ILE HD1% A 27 ILE HA 1.0 1.8 3.5 847 466 A 27 ILE HB A 27 ILE HD1% 1.0 1.8 4.5 848 467 A 27 ILE HB A 27 ILE HD1% 1.0 1.8 2.8 849 468 A 27 ILE HG1x A 27 ILE HA 1.0 1.8 4.5 850 469 A 27 ILE HB A 27 ILE HG1x 1.0 1.8 4.5 851 470 A 27 ILE HB A 27 ILE HG1x 1.0 1.8 3.5 852 471 A 27 ILE HD1% A 27 ILE HG1x 1.0 1.8 2.8 853 472 A 27 ILE HD1% A 27 ILE HG1x 1.0 1.8 2.8 854 473 A 27 ILE HG1y A 27 ILE HA 1.0 1.8 3.5 855 474 A 27 ILE HB A 27 ILE HG1y 1.0 1.8 4.5 856 475 A 27 ILE HB A 27 ILE HG1y 1.0 1.8 3.5 857 476 A 27 ILE HD1% A 27 ILE HG1y 1.0 1.8 2.8 858 477 A 27 ILE HD1% A 27 ILE HG1y 1.0 1.8 2.8 859 478 A 27 ILE HA A 27 ILE HG2% 1.0 1.8 2.8 860 479 A 27 ILE HB A 27 ILE HG2% 1.0 1.8 3.5 861 480 A 27 ILE HB A 27 ILE HG2% 1.0 1.8 2.8 862 481 A 27 ILE HG1x A 27 ILE HG2% 1.0 1.8 3.5 863 482 A 27 ILE HG1x A 27 ILE HG2% 1.0 1.8 2.8 864 483 A 27 ILE HG1y A 27 ILE HG2% 1.0 1.8 3.5 865 484 A 27 ILE HA A 27 ILE H 1.0 1.8 4.5 866 485 A 27 ILE HB A 27 ILE H 1.0 1.8 4.5 867 486 A 27 ILE HG1x A 27 ILE H 1.0 1.8 4.5 868 487 A 27 ILE HG1y A 27 ILE H 1.0 1.8 4.5 869 488 A 27 ILE HG2% A 27 ILE H 1.0 1.8 4.5 870 489 A 24 GLN HA A 28 GLY H 1.0 1.8 4.5 871 490 A 27 ILE HA A 28 GLY H 1.0 1.8 4.5 872 491 A 27 ILE HB A 28 GLY H 1.0 1.8 4.5 873 492 A 27 ILE HG1y A 28 GLY H 1.0 1.8 5.5 874 493 A 27 ILE HG2% A 28 GLY H 1.0 1.8 4.5 875 494 A 28 GLY H A 28 GLY HAy 1.0 1.8 2.8 876 494 A 28 GLY H A 28 GLY HAx 1.0 1.8 2.8 877 495 A 27 ILE HG2% A 29 TRP HBx 1.0 1.8 3.5 878 496 A 29 TRP HBy A 27 ILE HG2% 1.0 1.8 4.5 879 497 A 27 ILE HG2% A 29 TRP HBx 1.0 1.8 4.5 880 497 A 29 TRP HBy A 27 ILE HG2% 1.0 1.8 4.5 881 498 A 27 ILE HG2% A 29 TRP HBx 1.0 1.8 5.5 882 498 A 29 TRP HBy A 27 ILE HG2% 1.0 1.8 5.5 883 499 A 27 ILE HG2% A 29 TRP H 1.0 1.8 3.5 884 500 A 29 TRP HA A 29 TRP HBx 1.0 1.8 3.5 885 500 A 29 TRP HA A 29 TRP HBy 1.0 1.8 3.5 886 501 A 29 TRP HA A 29 TRP HBx 1.0 1.8 3.5 887 501 A 29 TRP HA A 29 TRP HBy 1.0 1.8 3.5 888 502 A 29 TRP HD1 A 29 TRP HBx 1.0 1.8 5.5 889 502 A 29 TRP HD1 A 29 TRP HBy 1.0 1.8 5.5 890 503 A 29 TRP HD1 A 29 TRP HBx 1.0 1.8 4.5 891 503 A 29 TRP HD1 A 29 TRP HBy 1.0 1.8 4.5 892 504 A 29 TRP HE3 A 29 TRP HBx 1.0 1.8 4.5 893 504 A 29 TRP HBy A 29 TRP HE3 1.0 1.8 4.5 894 505 A 29 TRP HE3 A 29 TRP HBx 1.0 1.8 4.5 895 505 A 29 TRP HBy A 29 TRP HE3 1.0 1.8 4.5 896 506 A 29 TRP H A 29 TRP HBx 1.0 1.8 4.5 897 506 A 29 TRP HBy A 29 TRP H 1.0 1.8 4.5 898 507 A 29 TRP H A 29 TRP HBx 1.0 1.8 4.5 899 507 A 29 TRP HBy A 29 TRP H 1.0 1.8 4.5 900 508 A 30 CYS H A 29 TRP HBx 1.0 1.8 5.5 901 508 A 29 TRP HBy A 30 CYS H 1.0 1.8 5.5 902 509 A 30 CYS HA A 30 CYS HB3 1.0 1.8 3.5 903 510 A 30 CYS HB2 A 30 CYS HA 1.0 1.8 4.5 904 511 A 30 CYS HB3 A 30 CYS H 1.0 1.8 4.5 905 512 A 30 CYS HB2 A 30 CYS H 1.0 1.8 4.5 906 513 A 30 CYS H A 31 PRO HA 1.0 1.8 4.5 907 514 A 30 CYS HA A 31 PRO HDy 1.0 1.8 3.5 908 514 A 30 CYS HA A 31 PRO HDx 1.0 1.8 3.5 909 515 A 31 PRO HA A 31 PRO HBy 1.0 1.8 3.5 910 515 A 31 PRO HA A 31 PRO HBx 1.0 1.8 3.5 911 516 A 31 PRO HA A 31 PRO HBy 1.0 1.8 4.5 912 516 A 31 PRO HA A 31 PRO HBx 1.0 1.8 4.5 913 517 A 31 PRO HA A 31 PRO HBy 1.0 1.8 2.8 914 517 A 31 PRO HA A 31 PRO HBx 1.0 1.8 2.8 915 518 A 31 PRO HA A 31 PRO HBy 1.0 1.8 2.8 916 518 A 31 PRO HA A 31 PRO HBx 1.0 1.8 2.8 917 519 A 31 PRO HBy A 31 PRO HDy 1.0 1.8 5.5 918 519 A 31 PRO HBx A 31 PRO HDy 1.0 1.8 5.5 919 519 A 31 PRO HDx A 31 PRO HBy 1.0 1.8 5.5 920 519 A 31 PRO HDx A 31 PRO HBx 1.0 1.8 5.5 921 520 A 31 PRO HBy A 31 PRO HDy 1.0 1.8 4.5 922 520 A 31 PRO HBx A 31 PRO HDy 1.0 1.8 4.5 923 520 A 31 PRO HDx A 31 PRO HBy 1.0 1.8 4.5 924 520 A 31 PRO HDx A 31 PRO HBx 1.0 1.8 4.5 925 521 A 31 PRO HBy A 31 PRO HDy 1.0 1.8 4.5 926 521 A 31 PRO HBx A 31 PRO HDy 1.0 1.8 4.5 927 521 A 31 PRO HDx A 31 PRO HBy 1.0 1.8 4.5 928 521 A 31 PRO HDx A 31 PRO HBx 1.0 1.8 4.5 929 522 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 4.5 930 522 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 4.5 931 522 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 4.5 932 522 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 4.5 933 523 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 3.5 934 523 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 3.5 935 523 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 3.5 936 523 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 3.5 937 524 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 4.5 938 524 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 4.5 939 524 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 4.5 940 524 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 4.5 941 525 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 4.5 942 525 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 4.5 943 525 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 4.5 944 525 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 4.5 945 526 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 5.5 946 526 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 5.5 947 526 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 5.5 948 526 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 5.5 949 527 A 31 PRO HBy A 31 PRO HGy 1.0 1.8 5.5 950 527 A 31 PRO HBx A 31 PRO HGy 1.0 1.8 5.5 951 527 A 31 PRO HGx A 31 PRO HBy 1.0 1.8 5.5 952 527 A 31 PRO HBx A 31 PRO HGx 1.0 1.8 5.5 953 528 A 31 PRO HDx A 31 PRO HGy 1.0 1.8 5.5 954 528 A 31 PRO HDy A 31 PRO HGy 1.0 1.8 5.5 955 528 A 31 PRO HGx A 31 PRO HDy 1.0 1.8 5.5 956 528 A 31 PRO HDx A 31 PRO HGx 1.0 1.8 5.5 957 529 A 31 PRO HDx A 31 PRO HGy 1.0 1.8 4.5 958 529 A 31 PRO HDy A 31 PRO HGy 1.0 1.8 4.5 959 529 A 31 PRO HGx A 31 PRO HDy 1.0 1.8 4.5 960 529 A 31 PRO HDx A 31 PRO HGx 1.0 1.8 4.5 961 530 A 31 PRO HDy A 31 PRO HGy 1.0 1.8 4.5 962 530 A 31 PRO HDx A 31 PRO HGy 1.0 1.8 4.5 963 530 A 31 PRO HGx A 31 PRO HDy 1.0 1.8 4.5 964 530 A 31 PRO HDx A 31 PRO HGx 1.0 1.8 4.5 965 531 A 32 PHE HA A 32 PHE HBx 1.0 1.8 3.5 966 531 A 32 PHE HA A 32 PHE HBy 1.0 1.8 3.5 967 532 A 32 PHE HA A 32 PHE HBx 1.0 1.8 3.5 968 532 A 32 PHE HA A 32 PHE HBy 1.0 1.8 3.5 969 533 A 32 PHE HD% A 32 PHE HBx 1.0 1.8 4.5 970 533 A 32 PHE HD% A 32 PHE HBy 1.0 1.8 4.5 971 534 A 32 PHE HA A 32 PHE H 1.0 1.8 4.5 972 535 A 32 PHE H A 32 PHE HBx 1.0 1.8 5.5 973 535 A 32 PHE HBy A 32 PHE H 1.0 1.8 5.5 974 536 A 33 TRP HH2 A 19 ILE HG2% 1.0 1.8 3.5 975 537 A 33 TRP HZ2 A 19 ILE HB 1.0 1.8 4.5 976 538 A 19 ILE HG2% A 33 TRP HZ2 1.0 1.8 3.5 977 539 A 33 TRP HB2 A 20 GLU HGy 1.0 1.8 4.5 978 539 A 33 TRP HB2 A 20 GLU HGx 1.0 1.8 4.5 979 540 A 33 TRP HE3 A 30 CYS HB3 1.0 1.8 4.5 980 541 A 33 TRP HE3 A 30 CYS HB2 1.0 1.8 5.5 981 542 A 30 CYS HB3 A 33 TRP HZ3 1.0 1.8 4.5 982 543 A 30 CYS HB2 A 33 TRP HZ3 1.0 1.8 5.5 983 544 A 33 TRP H A 32 PHE HBx 1.0 1.8 5.5 984 544 A 32 PHE HBy A 33 TRP H 1.0 1.8 5.5 985 545 A 33 TRP HA A 33 TRP HB3 1.0 1.8 2.8 986 546 A 33 TRP HB2 A 33 TRP HA 1.0 1.8 3.5 987 547 A 33 TRP HD1 A 33 TRP HB3 1.0 1.8 4.5 988 548 A 33 TRP HB2 A 33 TRP HD1 1.0 1.8 5.5 989 549 A 33 TRP HE3 A 33 TRP HB3 1.0 1.8 4.5 990 550 A 33 TRP HE3 A 33 TRP HB2 1.0 1.8 3.5 991 551 A 33 TRP HB3 A 33 TRP H 1.0 1.8 4.5 992 552 A 33 TRP HB2 A 33 TRP H 1.0 1.8 3.5 993 553 A 6 PRO HA A 5 VAL HGx% 1.0 1.8 3.5 994 553 A 6 PRO HA A 9 VAL HGy% 1.0 1.8 3.5 995 554 A 10 ASP HA A 9 VAL HGx% 1.0 1.8 3.5 996 554 A 13 ILE HG2% A 10 ASP HA 1.0 1.8 3.5 997 555 A 13 ILE HG2% A 13 ILE HA 1.0 1.8 2.8 998 555 A 13 ILE HD1% A 13 ILE HA 1.0 1.8 2.8 999 556 A 17 THR HA A 17 THR HB 1.0 1.8 2.8 1000 556 A 17 THR HB A 14 GLN HA 1.0 1.8 2.8 1001 557 A 17 THR HA A 20 GLU HBy 1.0 1.8 2.8 1002 557 A 17 THR HA A 20 GLU HBx 1.0 1.8 2.8 1003 557 A 17 THR HA A 17 THR HG2% 1.0 1.8 2.8 1004 558 A 22 LEU HB3 A 19 ILE HA 1.0 1.8 3.5 1005 558 A 19 ILE HG1x A 19 ILE HA 1.0 1.8 3.5 1006 559 A 19 ILE HA A 22 LEU HB2 1.0 1.8 2.8 1007 559 A 19 ILE HB A 19 ILE HA 1.0 1.8 2.8 1008 560 A 22 LEU HDy% A 19 ILE HA 1.0 1.8 3.5 1009 560 A 19 ILE HD1% A 19 ILE HA 1.0 1.8 3.5 1010 561 A 1 ASN HA A 1 ASN HBy 1.0 1.8 3.5 1011 561 A 1 ASN HA A 1 ASN HBx 1.0 1.8 3.5 1012 562 A 1 ASN HA A 1 ASN HBy 1.0 1.8 4.5 1013 562 A 1 ASN HA A 1 ASN HBx 1.0 1.8 4.5 1014 563 A 1 ASN HA A 1 ASN HBy 1.0 1.8 3.5 1015 563 A 1 ASN HA A 1 ASN HBx 1.0 1.8 3.5 1016 564 A 1 ASN HA A 1 ASN HBy 1.0 1.8 3.5 1017 564 A 1 ASN HA A 1 ASN HBx 1.0 1.8 3.5 1018 565 A 2 GLU HA A 2 GLU HBx 1.0 1.8 3.5 1019 566 A 2 GLU HA A 2 GLU HBy 1.0 1.8 2.8 1020 567 A 2 GLU HA A 2 GLU HBy 1.0 1.8 2.8 1021 567 A 2 GLU HA A 2 GLU HBx 1.0 1.8 2.8 1022 568 A 2 GLU HA A 2 GLU HBy 1.0 1.8 3.5 1023 568 A 2 GLU HA A 2 GLU HBx 1.0 1.8 3.5 1024 569 A 2 GLU HA A 2 GLU HGx 1.0 1.8 4.5 1025 569 A 2 GLU HA A 2 GLU HGy 1.0 1.8 4.5 1026 570 A 2 GLU HA A 2 GLU HGx 1.0 1.8 4.5 1027 570 A 2 GLU HA A 2 GLU HGy 1.0 1.8 4.5 1028 571 A 2 GLU HBy A 2 GLU HGx 1.0 1.8 2.8 1029 571 A 2 GLU HBx A 2 GLU HGx 1.0 1.8 2.8 1030 571 A 2 GLU HGy A 2 GLU HBy 1.0 1.8 2.8 1031 571 A 2 GLU HBx A 2 GLU HGy 1.0 1.8 2.8 1032 572 A 2 GLU HBy A 2 GLU HGx 1.0 1.8 2.8 1033 572 A 2 GLU HBx A 2 GLU HGx 1.0 1.8 2.8 1034 572 A 2 GLU HGy A 2 GLU HBy 1.0 1.8 2.8 1035 572 A 2 GLU HBx A 2 GLU HGy 1.0 1.8 2.8 1036 573 A 3 LEU HA A 3 LEU HDx% 1.0 1.8 2.8 1037 573 A 3 LEU HA A 3 LEU HDy% 1.0 1.8 2.8 1038 574 A 3 LEU HA A 3 LEU HBx 1.0 1.8 2.8 1039 574 A 3 LEU HA A 3 LEU HBy 1.0 1.8 2.8 1040 575 A 4 ASP HA A 4 ASP HB3 1.0 1.8 2.8 1041 575 A 4 ASP HA A 4 ASP HB2 1.0 1.8 2.8 1042 576 A 4 ASP HA A 4 ASP HB3 1.0 1.8 2.8 1043 576 A 4 ASP HA A 4 ASP HB2 1.0 1.8 2.8 1044 577 A 4 ASP HA A 5 VAL HGx% 1.0 1.8 4.5 1045 577 A 4 ASP HA A 5 VAL HGy% 1.0 1.8 4.5 1046 578 A 5 VAL HB A 5 VAL HA 1.0 1.8 3.5 1047 579 A 4 ASP HA A 6 PRO HDy 1.0 1.8 4.5 1048 579 A 6 PRO HDx A 4 ASP HA 1.0 1.8 4.5 1049 580 A 4 ASP HA A 6 PRO HDy 1.0 1.8 4.5 1050 580 A 6 PRO HDx A 4 ASP HA 1.0 1.8 4.5 1051 581 A 4 ASP HA A 6 PRO HDy 1.0 1.8 4.5 1052 581 A 6 PRO HDx A 4 ASP HA 1.0 1.8 4.5 1053 582 A 4 ASP HB2 A 6 PRO HDy 1.0 1.8 4.5 1054 582 A 4 ASP HB3 A 6 PRO HDy 1.0 1.8 4.5 1055 582 A 6 PRO HDx A 4 ASP HB3 1.0 1.8 4.5 1056 582 A 6 PRO HDx A 4 ASP HB2 1.0 1.8 4.5 1057 583 A 6 PRO HA A 6 PRO HBy 1.0 1.8 2.8 1058 583 A 6 PRO HBx A 6 PRO HA 1.0 1.8 2.8 1059 584 A 6 PRO HA A 6 PRO HBy 1.0 1.8 2.8 1060 584 A 6 PRO HBx A 6 PRO HA 1.0 1.8 2.8 1061 585 A 6 PRO HA A 6 PRO HDy 1.0 1.8 4.5 1062 585 A 6 PRO HDx A 6 PRO HA 1.0 1.8 4.5 1063 586 A 6 PRO HA A 6 PRO HDy 1.0 1.8 4.5 1064 586 A 6 PRO HDx A 6 PRO HA 1.0 1.8 4.5 1065 587 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 5.5 1066 587 A 6 PRO HBx A 6 PRO HDy 1.0 1.8 5.5 1067 588 A 6 PRO HA A 6 PRO HGx 1.0 1.8 3.5 1068 588 A 6 PRO HGy A 6 PRO HA 1.0 1.8 3.5 1069 589 A 7 GLU HA A 7 GLU HBx 1.0 1.8 2.8 1070 589 A 7 GLU HBy A 7 GLU HA 1.0 1.8 2.8 1071 590 A 7 GLU HA A 7 GLU HGy 1.0 1.8 3.5 1072 590 A 7 GLU HA A 7 GLU HGx 1.0 1.8 3.5 1073 591 A 7 GLU HA A 7 GLU HGy 1.0 1.8 3.5 1074 591 A 7 GLU HA A 7 GLU HGx 1.0 1.8 3.5 1075 592 A 6 PRO HA A 9 VAL HB 1.0 1.8 3.5 1076 593 A 6 PRO HA A 9 VAL HGy% 1.0 1.8 4.5 1077 594 A 9 VAL HB A 9 VAL HA 1.0 1.8 3.5 1078 595 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 2.8 1079 595 A 9 VAL HGy% A 9 VAL HA 1.0 1.8 2.8 1080 596 A 7 GLU HA A 10 ASP HBx 1.0 1.8 2.8 1081 596 A 7 GLU HA A 10 ASP HBy 1.0 1.8 2.8 1082 597 A 10 ASP HA A 10 ASP HBx 1.0 1.8 2.8 1083 597 A 10 ASP HBy A 10 ASP HA 1.0 1.8 2.8 1084 598 A 9 VAL HA A 12 LEU HB3 1.0 1.8 4.5 1085 599 A 9 VAL HA A 12 LEU HB2 1.0 1.8 3.5 1086 600 A 9 VAL HA A 12 LEU HG 1.0 1.8 4.5 1087 601 A 13 ILE HB A 10 ASP HA 1.0 1.8 2.8 1088 602 A 13 ILE HD1% A 10 ASP HA 1.0 1.8 3.5 1089 603 A 13 ILE HG1x A 10 ASP HA 1.0 1.8 4.5 1090 604 A 13 ILE HG1y A 10 ASP HA 1.0 1.8 4.5 1091 605 A 13 ILE HA A 13 ILE HB 1.0 1.8 3.5 1092 606 A 13 ILE HD1% A 13 ILE HA 1.0 1.8 3.5 1093 607 A 13 ILE HG1x A 13 ILE HA 1.0 1.8 3.5 1094 608 A 13 ILE HG1y A 13 ILE HA 1.0 1.8 3.5 1095 609 A 11 LYS HA A 14 GLN HB3 1.0 1.8 3.5 1096 610 A 11 LYS HA A 14 GLN HB3 1.0 1.8 4.5 1097 611 A 11 LYS HA A 14 GLN HB2 1.0 1.8 4.5 1098 612 A 11 LYS HA A 14 GLN HGy 1.0 1.8 4.5 1099 612 A 11 LYS HA A 14 GLN HGx 1.0 1.8 4.5 1100 613 A 11 LYS HA A 14 GLN HGy 1.0 1.8 4.5 1101 613 A 11 LYS HA A 14 GLN HGx 1.0 1.8 4.5 1102 614 A 13 ILE HG2% A 14 GLN HA 1.0 1.8 3.5 1103 615 A 15 GLN HB3 A 15 GLN HA 1.0 1.8 2.8 1104 616 A 15 GLN HB2 A 15 GLN HA 1.0 1.8 2.8 1105 617 A 15 GLN HA A 15 GLN HGx 1.0 1.8 2.8 1106 617 A 15 GLN HA A 15 GLN HGy 1.0 1.8 2.8 1107 618 A 13 ILE HA A 16 ALA HB% 1.0 1.8 3.5 1108 619 A 16 ALA HB% A 16 ALA HA 1.0 1.8 2.8 1109 620 A 17 THR HB A 17 THR HG2% 1.0 1.8 2.8 1110 621 A 18 SER HB3 A 18 SER HA 1.0 1.8 2.8 1111 622 A 18 SER HA A 18 SER HB2 1.0 1.8 2.8 1112 623 A 19 ILE HB A 16 ALA HA 1.0 1.8 4.5 1113 624 A 19 ILE HD1% A 16 ALA HA 1.0 1.8 4.5 1114 625 A 19 ILE HG2% A 16 ALA HA 1.0 1.8 4.5 1115 626 A 19 ILE HA A 19 ILE HG1y 1.0 1.8 2.8 1116 627 A 19 ILE HG2% A 19 ILE HA 1.0 1.8 2.8 1117 628 A 17 THR HA A 20 GLU HGy 1.0 1.8 4.5 1118 628 A 17 THR HA A 20 GLU HGx 1.0 1.8 4.5 1119 629 A 18 SER HA A 21 ARG HBy 1.0 1.8 3.5 1120 629 A 18 SER HA A 21 ARG HBx 1.0 1.8 3.5 1121 630 A 18 SER HB3 A 21 ARG HBy 1.0 1.8 4.5 1122 630 A 18 SER HB3 A 21 ARG HBx 1.0 1.8 4.5 1123 631 A 19 ILE HA A 22 LEU HDx% 1.0 1.8 4.5 1124 632 A 22 LEU HG A 19 ILE HA 1.0 1.8 4.5 1125 633 A 22 LEU HA A 22 LEU HB3 1.0 1.8 2.8 1126 634 A 22 LEU HA A 22 LEU HB2 1.0 1.8 2.8 1127 635 A 22 LEU HA A 22 LEU HDx% 1.0 1.8 2.8 1128 635 A 22 LEU HA A 22 LEU HDy% 1.0 1.8 2.8 1129 636 A 22 LEU HA A 22 LEU HG 1.0 1.8 3.5 1130 637 A 23 CYS HA A 23 CYS HBx 1.0 1.8 3.5 1131 638 A 23 CYS HA A 23 CYS HBy 1.0 1.8 3.5 1132 639 A 25 HIS HB3 A 22 LEU HA 1.0 1.8 3.5 1133 640 A 25 HIS HB2 A 22 LEU HA 1.0 1.8 4.5 1134 641 A 25 HIS HB2 A 24 GLN HBy 1.0 1.8 5.5 1135 641 A 25 HIS HB2 A 24 GLN HBx 1.0 1.8 5.5 1136 642 A 25 HIS HB3 A 25 HIS HA 1.0 1.8 3.5 1137 643 A 25 HIS HB2 A 25 HIS HA 1.0 1.8 2.8 1138 644 A 26 TYR HD% A 22 LEU HA 1.0 1.8 3.5 1139 645 A 26 TYR HD% A 22 LEU HDx% 1.0 1.8 4.5 1140 646 A 22 LEU HA A 26 TYR HE% 1.0 1.8 4.5 1141 647 A 25 HIS HB3 A 26 TYR HE% 1.0 1.8 5.5 1142 648 A 26 TYR HB3 A 26 TYR HA 1.0 1.8 3.5 1143 649 A 26 TYR HB2 A 26 TYR HA 1.0 1.8 4.5 1144 650 A 26 TYR HD% A 26 TYR HA 1.0 1.8 3.5 1145 651 A 23 CYS HA A 27 ILE HB 1.0 1.8 4.5 1146 652 A 23 CYS HA A 27 ILE HD1% 1.0 1.8 4.5 1147 653 A 23 CYS HA A 27 ILE HG1x 1.0 1.8 4.5 1148 654 A 23 CYS HA A 27 ILE HG1y 1.0 1.8 4.5 1149 655 A 26 TYR HB2 A 27 ILE HG1x 1.0 1.8 4.5 1150 656 A 26 TYR HB3 A 27 ILE HG1y 1.0 1.8 4.5 1151 657 A 26 TYR HB3 A 27 ILE HG1y 1.0 1.8 5.5 1152 658 A 27 ILE HB A 27 ILE HA 1.0 1.8 3.5 1153 659 A 27 ILE HD1% A 27 ILE HA 1.0 1.8 3.5 1154 660 A 27 ILE HG1x A 27 ILE HA 1.0 1.8 4.5 1155 661 A 27 ILE HG1y A 27 ILE HA 1.0 1.8 3.5 1156 662 A 27 ILE HA A 27 ILE HG2% 1.0 1.8 2.8 1157 663 A 24 GLN HA A 28 GLY HAy 1.0 1.8 3.5 1158 663 A 24 GLN HA A 28 GLY HAx 1.0 1.8 3.5 1159 664 A 24 GLN HA A 28 GLY HAy 1.0 1.8 4.5 1160 664 A 24 GLN HA A 28 GLY HAx 1.0 1.8 4.5 1161 665 A 24 GLN HA A 28 GLY HAy 1.0 1.8 4.5 1162 665 A 24 GLN HA A 28 GLY HAx 1.0 1.8 4.5 1163 666 A 24 GLN HA A 28 GLY HAy 1.0 1.8 3.5 1164 666 A 24 GLN HA A 28 GLY HAx 1.0 1.8 3.5 1165 667 A 29 TRP HA A 29 TRP HBx 1.0 1.8 3.5 1166 667 A 29 TRP HA A 29 TRP HBy 1.0 1.8 3.5 1167 668 A 29 TRP HA A 29 TRP HBx 1.0 1.8 2.8 1168 668 A 29 TRP HA A 29 TRP HBy 1.0 1.8 2.8 1169 669 A 29 TRP HD1 A 29 TRP HA 1.0 1.8 3.5 1170 670 A 29 TRP HA A 29 TRP HE3 1.0 1.8 5.5 1171 671 A 30 CYS HA A 30 CYS HB3 1.0 1.8 3.5 1172 672 A 30 CYS HB2 A 30 CYS HA 1.0 1.8 3.5 1173 673 A 30 CYS HA A 31 PRO HDy 1.0 1.8 2.8 1174 673 A 30 CYS HA A 31 PRO HDx 1.0 1.8 2.8 1175 674 A 30 CYS HA A 31 PRO HDy 1.0 1.8 3.5 1176 674 A 30 CYS HA A 31 PRO HDx 1.0 1.8 3.5 1177 675 A 32 PHE HA A 31 PRO HBy 1.0 1.8 4.5 1178 675 A 32 PHE HA A 31 PRO HBx 1.0 1.8 4.5 1179 676 A 32 PHE HA A 31 PRO HBy 1.0 1.8 4.5 1180 676 A 32 PHE HA A 31 PRO HBx 1.0 1.8 4.5 1181 677 A 32 PHE HA A 32 PHE HBx 1.0 1.8 2.8 1182 677 A 32 PHE HA A 32 PHE HBy 1.0 1.8 2.8 1183 678 A 32 PHE HD% A 32 PHE HA 1.0 1.8 3.5 1184 679 A 33 TRP HB2 A 20 GLU HGy 1.0 1.8 4.5 1185 679 A 33 TRP HB2 A 20 GLU HGx 1.0 1.8 4.5 1186 680 A 30 CYS HA A 33 TRP HZ3 1.0 1.8 4.5 1187 681 A 33 TRP HA A 33 TRP HB3 1.0 1.8 2.8 1188 682 A 33 TRP HB2 A 33 TRP HA 1.0 1.8 2.8 1189 683 A 33 TRP HD1 A 33 TRP HA 1.0 1.8 3.5 1190 684 A 3 LEU HA A 3 LEU H 1.0 1.8 2.8 1191 684 A 2 GLU HA A 3 LEU H 1.0 1.8 2.8 1192 685 A 3 LEU HA A 4 ASP H 1.0 1.8 2.8 1193 685 A 2 GLU HA A 4 ASP H 1.0 1.8 2.8 1194 686 A 7 GLU H A 6 PRO HGx 1.0 1.8 2.8 1195 686 A 7 GLU H A 7 GLU HBx 1.0 1.8 2.8 1196 686 A 7 GLU H A 7 GLU HBy 1.0 1.8 2.8 1197 687 A 8 GLN H A 6 PRO HBy 1.0 1.8 3.5 1198 687 A 8 GLN HGy A 8 GLN H 1.0 1.8 3.5 1199 687 A 8 GLN H A 8 GLN HGx 1.0 1.8 3.5 1200 688 A 8 GLN HA A 8 GLN H 1.0 1.8 2.8 1201 688 A 7 GLU HA A 8 GLN H 1.0 1.8 2.8 1202 689 A 8 GLN HBy A 8 GLN H 1.0 1.8 2.8 1203 689 A 8 GLN H A 8 GLN HBx 1.0 1.8 2.8 1204 689 A 8 GLN H A 7 GLU HBx 1.0 1.8 2.8 1205 690 A 7 GLU H A 5 VAL HGx% 1.0 1.8 5.5 1206 690 A 7 GLU H A 9 VAL HGy% 1.0 1.8 5.5 1207 690 A 7 GLU H A 9 VAL HGx% 1.0 1.8 5.5 1208 691 A 9 VAL H A 8 GLN HA 1.0 1.8 2.8 1209 691 A 9 VAL H A 7 GLU HA 1.0 1.8 2.8 1210 692 A 12 LEU H A 11 LYS HBy 1.0 1.8 2.8 1211 692 A 12 LEU HB2 A 12 LEU H 1.0 1.8 2.8 1212 692 A 11 LYS HBx A 12 LEU H 1.0 1.8 2.8 1213 693 A 12 LEU HB3 A 12 LEU H 1.0 1.8 3.5 1214 693 A 12 LEU H A 11 LYS HDy 1.0 1.8 3.5 1215 693 A 11 LYS HDx A 12 LEU H 1.0 1.8 3.5 1216 694 A 13 ILE H A 13 ILE HA 1.0 1.8 2.8 1217 694 A 13 ILE H A 9 VAL HA 1.0 1.8 2.8 1218 695 A 13 ILE H A 13 ILE HG1x 1.0 1.8 2.8 1219 695 A 13 ILE H A 12 LEU HB3 1.0 1.8 2.8 1220 696 A 13 ILE H A 13 ILE HG2% 1.0 1.8 3.5 1221 696 A 13 ILE H A 13 ILE HD1% 1.0 1.8 3.5 1222 697 A 14 GLN HA A 15 GLN H 1.0 1.8 2.8 1223 697 A 12 LEU HA A 15 GLN H 1.0 1.8 2.8 1224 698 A 15 GLN HB3 A 15 GLN H 1.0 1.8 3.5 1225 698 A 14 GLN HB3 A 15 GLN H 1.0 1.8 3.5 1226 699 A 15 GLN HB2 A 15 GLN H 1.0 1.8 2.8 1227 699 A 14 GLN HB2 A 15 GLN H 1.0 1.8 2.8 1228 700 A 16 ALA H A 15 GLN H 1.0 1.8 2.8 1229 700 A 14 GLN H A 15 GLN H 1.0 1.8 2.8 1230 701 A 17 THR H A 17 THR HA 1.0 1.8 3.5 1231 701 A 17 THR H A 14 GLN HA 1.0 1.8 3.5 1232 702 A 17 THR H A 17 THR HB 1.0 1.8 2.8 1233 702 A 16 ALA HA A 17 THR H 1.0 1.8 2.8 1234 702 A 17 THR H A 15 GLN HA 1.0 1.8 2.8 1235 703 A 18 SER H A 17 THR HB 1.0 1.8 3.5 1236 703 A 18 SER H A 15 GLN HA 1.0 1.8 3.5 1237 704 A 19 ILE H A 20 GLU H 1.0 1.8 2.8 1238 704 A 18 SER H A 19 ILE H 1.0 1.8 2.8 1239 705 A 20 GLU H A 20 GLU HGx 1.0 1.8 2.8 1240 705 A 20 GLU H A 20 GLU HGy 1.0 1.8 2.8 1241 705 A 19 ILE HG1x A 20 GLU H 1.0 1.8 2.8 1242 706 A 22 LEU HG A 22 LEU H 1.0 1.8 2.8 1243 706 A 22 LEU H A 21 ARG HBy 1.0 1.8 2.8 1244 706 A 22 LEU H A 21 ARG HBx 1.0 1.8 2.8 1245 707 A 23 CYS H A 23 CYS HBx 1.0 1.8 2.8 1246 707 A 23 CYS H A 23 CYS HBy 1.0 1.8 2.8 1247 707 A 20 GLU HA A 23 CYS H 1.0 1.8 2.8 1248 708 A 22 LEU H A 21 ARG HDy 1.0 1.8 5.5 1249 708 A 22 LEU H A 23 CYS HBx 1.0 1.8 5.5 1250 708 A 22 LEU H A 21 ARG HDx 1.0 1.8 5.5 1251 709 A 24 GLN HA A 25 HIS H 1.0 1.8 4.5 1252 709 A 21 ARG HA A 25 HIS H 1.0 1.8 4.5 1253 710 A 25 HIS HA A 25 HIS H 1.0 1.8 2.8 1254 710 A 22 LEU HA A 25 HIS H 1.0 1.8 2.8 1255 711 A 26 TYR HB2 A 26 TYR H 1.0 1.8 2.8 1256 711 A 25 HIS HB3 A 26 TYR H 1.0 1.8 2.8 1257 712 A 26 TYR HB3 A 26 TYR H 1.0 1.8 3.5 1258 712 A 25 HIS HB2 A 26 TYR H 1.0 1.8 3.5 1259 713 A 26 TYR H A 27 ILE H 1.0 1.8 2.8 1260 713 A 25 HIS H A 26 TYR H 1.0 1.8 2.8 1261 714 A 32 PHE HA A 32 PHE H 1.0 1.8 3.5 1262 714 A 31 PRO HA A 32 PHE H 1.0 1.8 3.5 1263 715 A 32 PHE HA A 33 TRP H 1.0 1.8 2.8 1264 715 A 31 PRO HA A 33 TRP H 1.0 1.8 2.8 1265 716 A 3 LEU H A 1 ASN HBy 1.0 1.8 5.5 1266 716 A 3 LEU H A 1 ASN HBx 1.0 1.8 5.5 1267 717 A 3 LEU H A 2 GLU HBy 1.0 1.8 4.5 1268 717 A 3 LEU H A 2 GLU HBx 1.0 1.8 4.5 1269 718 A 3 LEU H A 2 GLU HBy 1.0 1.8 5.5 1270 718 A 3 LEU H A 2 GLU HBx 1.0 1.8 5.5 1271 719 A 3 LEU H A 3 LEU HDx% 1.0 1.8 4.5 1272 719 A 3 LEU H A 3 LEU HDy% 1.0 1.8 4.5 1273 720 A 3 LEU H A 3 LEU HBx 1.0 1.8 2.8 1274 720 A 3 LEU HBy A 3 LEU H 1.0 1.8 2.8 1275 721 A 4 ASP H A 2 GLU HBy 1.0 1.8 4.5 1276 721 A 4 ASP H A 2 GLU HBx 1.0 1.8 4.5 1277 722 A 4 ASP H A 3 LEU HBx 1.0 1.8 3.5 1278 722 A 3 LEU HBy A 4 ASP H 1.0 1.8 3.5 1279 723 A 4 ASP H A 4 ASP HB3 1.0 1.8 2.8 1280 723 A 4 ASP H A 4 ASP HB2 1.0 1.8 2.8 1281 724 A 4 ASP H A 4 ASP HB3 1.0 1.8 3.5 1282 724 A 4 ASP H A 4 ASP HB2 1.0 1.8 3.5 1283 725 A 4 ASP H A 5 VAL HGx% 1.0 1.8 4.5 1284 725 A 4 ASP H A 5 VAL HGy% 1.0 1.8 4.5 1285 726 A 5 VAL H A 4 ASP HA 1.0 1.8 2.8 1286 727 A 5 VAL H A 4 ASP HB3 1.0 1.8 4.5 1287 727 A 5 VAL H A 4 ASP HB2 1.0 1.8 4.5 1288 728 A 5 VAL H A 4 ASP HB3 1.0 1.8 4.5 1289 728 A 5 VAL H A 4 ASP HB2 1.0 1.8 4.5 1290 729 A 5 VAL H A 5 VAL HA 1.0 1.8 2.8 1291 730 A 5 VAL H A 5 VAL HB 1.0 1.8 2.8 1292 731 A 5 VAL H A 5 VAL HGx% 1.0 1.8 2.8 1293 731 A 5 VAL H A 5 VAL HGy% 1.0 1.8 2.8 1294 732 A 5 VAL H A 6 PRO HDy 1.0 1.8 3.5 1295 732 A 5 VAL H A 6 PRO HDx 1.0 1.8 3.5 1296 733 A 5 VAL H A 6 PRO HDy 1.0 1.8 3.5 1297 733 A 5 VAL H A 6 PRO HDx 1.0 1.8 3.5 1298 734 A 6 PRO HA A 7 GLU H 1.0 1.8 2.8 1299 735 A 7 GLU H A 6 PRO HBy 1.0 1.8 4.5 1300 735 A 6 PRO HBx A 7 GLU H 1.0 1.8 4.5 1301 736 A 7 GLU H A 6 PRO HBy 1.0 1.8 3.5 1302 736 A 6 PRO HBx A 7 GLU H 1.0 1.8 3.5 1303 737 A 7 GLU H A 6 PRO HDy 1.0 1.8 5.5 1304 737 A 6 PRO HDx A 7 GLU H 1.0 1.8 5.5 1305 738 A 7 GLU H A 7 GLU HA 1.0 1.8 2.8 1306 739 A 7 GLU H A 7 GLU HGy 1.0 1.8 4.5 1307 739 A 7 GLU H A 7 GLU HGx 1.0 1.8 4.5 1308 740 A 7 GLU H A 7 GLU HGy 1.0 1.8 5.5 1309 740 A 7 GLU H A 7 GLU HGx 1.0 1.8 5.5 1310 741 A 8 GLN HE2y A 8 GLN HGx 1.0 1.8 3.5 1311 741 A 8 GLN HE2x A 8 GLN HGx 1.0 1.8 3.5 1312 741 A 8 GLN HGy A 8 GLN HE2x 1.0 1.8 3.5 1313 741 A 8 GLN HGy A 8 GLN HE2y 1.0 1.8 3.5 1314 742 A 8 GLN HE2y A 8 GLN HGx 1.0 1.8 4.5 1315 742 A 8 GLN HE2x A 8 GLN HGx 1.0 1.8 4.5 1316 742 A 8 GLN HGy A 8 GLN HE2x 1.0 1.8 4.5 1317 742 A 8 GLN HGy A 8 GLN HE2y 1.0 1.8 4.5 1318 743 A 9 VAL H A 6 PRO HA 1.0 1.8 5.5 1319 744 A 9 VAL H A 6 PRO HBy 1.0 1.8 4.5 1320 744 A 9 VAL H A 6 PRO HBx 1.0 1.8 4.5 1321 745 A 8 GLN H A 9 VAL HGx% 1.0 1.8 4.5 1322 745 A 8 GLN H A 9 VAL HGy% 1.0 1.8 4.5 1323 746 A 9 VAL H A 8 GLN HBx 1.0 1.8 3.5 1324 746 A 9 VAL H A 8 GLN HBy 1.0 1.8 3.5 1325 747 A 9 VAL H A 8 GLN H 1.0 1.8 2.8 1326 748 A 9 VAL H A 8 GLN H 1.0 1.8 3.5 1327 749 A 9 VAL H A 9 VAL HA 1.0 1.8 2.8 1328 750 A 9 VAL H A 9 VAL HB 1.0 1.8 2.8 1329 751 A 9 VAL H A 9 VAL HGx% 1.0 1.8 2.8 1330 751 A 9 VAL H A 9 VAL HGy% 1.0 1.8 2.8 1331 752 A 10 ASP H A 7 GLU HA 1.0 1.8 3.5 1332 753 A 10 ASP H A 9 VAL HA 1.0 1.8 3.5 1333 754 A 10 ASP H A 9 VAL HB 1.0 1.8 2.8 1334 755 A 10 ASP H A 9 VAL HGx% 1.0 1.8 3.5 1335 755 A 10 ASP H A 9 VAL HGy% 1.0 1.8 3.5 1336 756 A 9 VAL H A 10 ASP H 1.0 1.8 2.8 1337 757 A 9 VAL H A 10 ASP H 1.0 1.8 2.8 1338 758 A 10 ASP H A 10 ASP HA 1.0 1.8 2.8 1339 759 A 10 ASP H A 10 ASP HBx 1.0 1.8 2.8 1340 759 A 10 ASP H A 10 ASP HBy 1.0 1.8 2.8 1341 760 A 8 GLN HA A 11 LYS H 1.0 1.8 3.5 1342 761 A 9 VAL HA A 11 LYS H 1.0 1.8 5.5 1343 762 A 10 ASP HA A 11 LYS H 1.0 1.8 3.5 1344 763 A 11 LYS H A 10 ASP HBx 1.0 1.8 2.8 1345 763 A 10 ASP HBy A 11 LYS H 1.0 1.8 2.8 1346 764 A 10 ASP H A 11 LYS H 1.0 1.8 3.5 1347 765 A 10 ASP H A 11 LYS H 1.0 1.8 2.8 1348 766 A 11 LYS H A 11 LYS HA 1.0 1.8 2.8 1349 767 A 11 LYS H A 11 LYS HBy 1.0 1.8 2.8 1350 767 A 11 LYS HBx A 11 LYS H 1.0 1.8 2.8 1351 768 A 11 LYS H A 11 LYS HDy 1.0 1.8 4.5 1352 768 A 11 LYS HDx A 11 LYS H 1.0 1.8 4.5 1353 769 A 11 LYS H A 11 LYS HGy 1.0 1.8 3.5 1354 769 A 11 LYS HGx A 11 LYS H 1.0 1.8 3.5 1355 770 A 11 LYS H A 11 LYS HGy 1.0 1.8 3.5 1356 770 A 11 LYS HGx A 11 LYS H 1.0 1.8 3.5 1357 771 A 9 VAL HA A 12 LEU H 1.0 1.8 3.5 1358 772 A 11 LYS H A 12 LEU HDx% 1.0 1.8 5.5 1359 772 A 11 LYS H A 12 LEU HDy% 1.0 1.8 5.5 1360 773 A 11 LYS HA A 12 LEU H 1.0 1.8 3.5 1361 774 A 11 LYS H A 12 LEU H 1.0 1.8 2.8 1362 775 A 11 LYS H A 12 LEU H 1.0 1.8 2.8 1363 776 A 12 LEU H A 12 LEU HA 1.0 1.8 2.8 1364 777 A 12 LEU H A 12 LEU HDx% 1.0 1.8 3.5 1365 777 A 12 LEU HDy% A 12 LEU H 1.0 1.8 3.5 1366 778 A 12 LEU HG A 12 LEU H 1.0 1.8 3.5 1367 779 A 13 ILE H A 10 ASP HA 1.0 1.8 3.5 1368 780 A 13 ILE H A 12 LEU HA 1.0 1.8 3.5 1369 781 A 13 ILE H A 12 LEU HB2 1.0 1.8 3.5 1370 782 A 13 ILE H A 12 LEU H 1.0 1.8 2.8 1371 783 A 13 ILE H A 12 LEU H 1.0 1.8 2.8 1372 784 A 13 ILE H A 13 ILE HB 1.0 1.8 2.8 1373 785 A 13 ILE H A 13 ILE HG1y 1.0 1.8 2.8 1374 786 A 11 LYS H A 14 GLN HB2 1.0 1.8 5.5 1375 787 A 14 GLN H A 11 LYS HA 1.0 1.8 4.5 1376 788 A 13 ILE HG2% A 14 GLN HE2x 1.0 1.8 5.5 1377 788 A 13 ILE HG2% A 14 GLN HE2y 1.0 1.8 5.5 1378 789 A 13 ILE HA A 14 GLN H 1.0 1.8 3.5 1379 790 A 14 GLN H A 13 ILE HB 1.0 1.8 3.5 1380 791 A 13 ILE HG1x A 14 GLN H 1.0 1.8 5.5 1381 792 A 13 ILE HG2% A 14 GLN H 1.0 1.8 4.5 1382 793 A 14 GLN HB2 A 14 GLN HE2x 1.0 1.8 5.5 1383 793 A 14 GLN HB2 A 14 GLN HE2y 1.0 1.8 5.5 1384 794 A 14 GLN HB2 A 14 GLN HE2x 1.0 1.8 5.5 1385 794 A 14 GLN HB2 A 14 GLN HE2y 1.0 1.8 5.5 1386 795 A 14 GLN HE2x A 14 GLN HGy 1.0 1.8 3.5 1387 795 A 14 GLN HE2y A 14 GLN HGy 1.0 1.8 3.5 1388 795 A 14 GLN HGx A 14 GLN HE2x 1.0 1.8 3.5 1389 795 A 14 GLN HGx A 14 GLN HE2y 1.0 1.8 3.5 1390 796 A 14 GLN HE2x A 14 GLN HGy 1.0 1.8 3.5 1391 796 A 14 GLN HE2y A 14 GLN HGy 1.0 1.8 3.5 1392 796 A 14 GLN HGx A 14 GLN HE2x 1.0 1.8 3.5 1393 796 A 14 GLN HGx A 14 GLN HE2y 1.0 1.8 3.5 1394 797 A 14 GLN H A 14 GLN HA 1.0 1.8 2.8 1395 798 A 14 GLN H A 14 GLN HB3 1.0 1.8 3.5 1396 799 A 14 GLN H A 14 GLN HB2 1.0 1.8 2.8 1397 800 A 14 GLN H A 14 GLN HGy 1.0 1.8 3.5 1398 800 A 14 GLN H A 14 GLN HGx 1.0 1.8 3.5 1399 801 A 13 ILE HA A 15 GLN H 1.0 1.8 5.5 1400 802 A 14 GLN H A 15 GLN H 1.0 1.8 3.5 1401 803 A 15 GLN HB3 A 15 GLN HE2x 1.0 1.8 4.5 1402 803 A 15 GLN HB3 A 15 GLN HE2y 1.0 1.8 4.5 1403 804 A 15 GLN HE2x A 15 GLN HGx 1.0 1.8 3.5 1404 804 A 15 GLN HE2y A 15 GLN HGx 1.0 1.8 3.5 1405 804 A 15 GLN HGy A 15 GLN HE2x 1.0 1.8 3.5 1406 804 A 15 GLN HGy A 15 GLN HE2y 1.0 1.8 3.5 1407 805 A 15 GLN HE2x A 15 GLN HGx 1.0 1.8 3.5 1408 805 A 15 GLN HE2y A 15 GLN HGx 1.0 1.8 3.5 1409 805 A 15 GLN HGy A 15 GLN HE2x 1.0 1.8 3.5 1410 805 A 15 GLN HGy A 15 GLN HE2y 1.0 1.8 3.5 1411 806 A 15 GLN H A 15 GLN HA 1.0 1.8 2.8 1412 807 A 15 GLN H A 15 GLN HGx 1.0 1.8 2.8 1413 807 A 15 GLN H A 15 GLN HGy 1.0 1.8 2.8 1414 808 A 13 ILE HA A 16 ALA H 1.0 1.8 4.5 1415 809 A 16 ALA H A 14 GLN HA 1.0 1.8 5.5 1416 810 A 16 ALA H A 15 GLN HA 1.0 1.8 3.5 1417 811 A 16 ALA H A 15 GLN HB3 1.0 1.8 4.5 1418 812 A 16 ALA H A 15 GLN HB2 1.0 1.8 3.5 1419 813 A 16 ALA H A 15 GLN HGx 1.0 1.8 4.5 1420 813 A 16 ALA H A 15 GLN HGy 1.0 1.8 4.5 1421 814 A 16 ALA H A 15 GLN H 1.0 1.8 2.8 1422 815 A 16 ALA H A 16 ALA HA 1.0 1.8 3.5 1423 816 A 16 ALA HB% A 16 ALA H 1.0 1.8 2.8 1424 817 A 16 ALA HB% A 17 THR H 1.0 1.8 3.5 1425 818 A 17 THR H A 17 THR HG2% 1.0 1.8 3.5 1426 819 A 17 THR HA A 18 SER H 1.0 1.8 3.5 1427 820 A 18 SER H A 17 THR HG2% 1.0 1.8 4.5 1428 821 A 17 THR H A 18 SER H 1.0 1.8 4.5 1429 822 A 18 SER H A 18 SER HA 1.0 1.8 3.5 1430 823 A 18 SER H A 18 SER HB3 1.0 1.8 4.5 1431 824 A 18 SER H A 18 SER HB2 1.0 1.8 3.5 1432 825 A 18 SER HA A 19 ILE H 1.0 1.8 3.5 1433 826 A 18 SER HB3 A 19 ILE H 1.0 1.8 5.5 1434 827 A 18 SER HB2 A 19 ILE H 1.0 1.8 3.5 1435 828 A 18 SER H A 19 ILE H 1.0 1.8 3.5 1436 829 A 19 ILE H A 19 ILE HA 1.0 1.8 3.5 1437 830 A 19 ILE HB A 19 ILE H 1.0 1.8 2.8 1438 831 A 19 ILE HD1% A 19 ILE H 1.0 1.8 4.5 1439 832 A 19 ILE HG1x A 19 ILE H 1.0 1.8 2.8 1440 833 A 19 ILE H A 19 ILE HG1y 1.0 1.8 3.5 1441 834 A 19 ILE HG2% A 19 ILE H 1.0 1.8 3.5 1442 835 A 17 THR HA A 20 GLU H 1.0 1.8 4.5 1443 836 A 18 SER HA A 20 GLU H 1.0 1.8 5.5 1444 837 A 18 SER HB3 A 20 GLU H 1.0 1.8 4.5 1445 838 A 19 ILE HA A 20 GLU H 1.0 1.8 3.5 1446 839 A 19 ILE HB A 20 GLU H 1.0 1.8 2.8 1447 840 A 19 ILE HG2% A 20 GLU H 1.0 1.8 3.5 1448 841 A 19 ILE H A 20 GLU H 1.0 1.8 2.8 1449 842 A 20 GLU H A 20 GLU HA 1.0 1.8 3.5 1450 843 A 20 GLU H A 20 GLU HBx 1.0 1.8 3.5 1451 843 A 20 GLU H A 20 GLU HBy 1.0 1.8 3.5 1452 844 A 20 GLU H A 20 GLU HGy 1.0 1.8 3.5 1453 844 A 20 GLU H A 20 GLU HGx 1.0 1.8 3.5 1454 845 A 18 SER H A 21 ARG HBy 1.0 1.8 4.5 1455 845 A 18 SER H A 21 ARG HBx 1.0 1.8 4.5 1456 846 A 18 SER HA A 21 ARG H 1.0 1.8 4.5 1457 847 A 19 ILE HA A 21 ARG H 1.0 1.8 5.5 1458 848 A 20 GLU HA A 21 ARG H 1.0 1.8 4.5 1459 849 A 21 ARG H A 20 GLU HBx 1.0 1.8 4.5 1460 849 A 20 GLU HBy A 21 ARG H 1.0 1.8 4.5 1461 850 A 20 GLU H A 21 ARG H 1.0 1.8 2.8 1462 851 A 20 GLU H A 21 ARG H 1.0 1.8 2.8 1463 852 A 21 ARG HA A 21 ARG H 1.0 1.8 2.8 1464 853 A 21 ARG H A 21 ARG HBy 1.0 1.8 2.8 1465 853 A 21 ARG HBx A 21 ARG H 1.0 1.8 2.8 1466 854 A 21 ARG H A 21 ARG HDx 1.0 1.8 4.5 1467 854 A 21 ARG HDy A 21 ARG H 1.0 1.8 4.5 1468 855 A 21 ARG H A 21 ARG HGx 1.0 1.8 2.8 1469 855 A 21 ARG HGy A 21 ARG H 1.0 1.8 2.8 1470 856 A 21 ARG H A 21 ARG HGx 1.0 1.8 3.5 1471 856 A 21 ARG HGy A 21 ARG H 1.0 1.8 3.5 1472 857 A 22 LEU H A 19 ILE HA 1.0 1.8 3.5 1473 858 A 22 LEU H A 20 GLU H 1.0 1.8 4.5 1474 859 A 22 LEU H A 20 GLU H 1.0 1.8 4.5 1475 860 A 22 LEU H A 20 GLU H 1.0 1.8 4.5 1476 861 A 21 ARG H A 22 LEU HB2 1.0 1.8 5.5 1477 862 A 21 ARG H A 22 LEU HDx% 1.0 1.8 5.5 1478 862 A 22 LEU HDy% A 21 ARG H 1.0 1.8 5.5 1479 863 A 21 ARG HA A 22 LEU H 1.0 1.8 3.5 1480 864 A 22 LEU H A 21 ARG H 1.0 1.8 2.8 1481 865 A 22 LEU H A 21 ARG H 1.0 1.8 2.8 1482 866 A 22 LEU HA A 22 LEU H 1.0 1.8 2.8 1483 867 A 22 LEU HB3 A 22 LEU H 1.0 1.8 3.5 1484 868 A 22 LEU H A 22 LEU HB2 1.0 1.8 2.8 1485 869 A 22 LEU H A 22 LEU HDx% 1.0 1.8 3.5 1486 869 A 22 LEU HDy% A 22 LEU H 1.0 1.8 3.5 1487 870 A 19 ILE HA A 23 CYS H 1.0 1.8 4.5 1488 871 A 22 LEU HA A 23 CYS H 1.0 1.8 3.5 1489 872 A 22 LEU HB3 A 23 CYS H 1.0 1.8 3.5 1490 873 A 22 LEU HB2 A 23 CYS H 1.0 1.8 2.8 1491 874 A 23 CYS H A 22 LEU HDx% 1.0 1.8 4.5 1492 874 A 22 LEU HDy% A 23 CYS H 1.0 1.8 4.5 1493 875 A 22 LEU HG A 23 CYS H 1.0 1.8 4.5 1494 876 A 22 LEU H A 23 CYS H 1.0 1.8 2.8 1495 877 A 22 LEU H A 23 CYS H 1.0 1.8 2.8 1496 878 A 23 CYS H A 23 CYS HA 1.0 1.8 3.5 1497 879 A 23 CYS H A 23 CYS HBx 1.0 1.8 2.8 1498 879 A 23 CYS H A 23 CYS HBy 1.0 1.8 2.8 1499 880 A 20 GLU HGx A 24 GLN HE2x 1.0 1.8 5.5 1500 880 A 20 GLU HGy A 24 GLN HE2x 1.0 1.8 5.5 1501 880 A 24 GLN HE2y A 20 GLU HGy 1.0 1.8 5.5 1502 880 A 20 GLU HGx A 24 GLN HE2y 1.0 1.8 5.5 1503 881 A 20 GLU HGx A 24 GLN HE2x 1.0 1.8 4.5 1504 881 A 20 GLU HGy A 24 GLN HE2x 1.0 1.8 4.5 1505 881 A 24 GLN HE2y A 20 GLU HGy 1.0 1.8 4.5 1506 881 A 20 GLU HGx A 24 GLN HE2y 1.0 1.8 4.5 1507 882 A 24 GLN H A 23 CYS HBx 1.0 1.8 4.5 1508 882 A 23 CYS HBy A 24 GLN H 1.0 1.8 4.5 1509 883 A 23 CYS H A 24 GLN H 1.0 1.8 3.5 1510 884 A 23 CYS H A 24 GLN H 1.0 1.8 5.5 1511 885 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 3.5 1512 885 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 3.5 1513 885 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 3.5 1514 885 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 3.5 1515 886 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 3.5 1516 886 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 3.5 1517 886 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 3.5 1518 886 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 3.5 1519 887 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 4.5 1520 887 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 4.5 1521 887 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 4.5 1522 887 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 4.5 1523 888 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 3.5 1524 888 A 24 GLN HGx A 24 GLN HE2x 1.0 1.8 3.5 1525 888 A 24 GLN HGx A 24 GLN HE2y 1.0 1.8 3.5 1526 888 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 3.5 1527 889 A 24 GLN H A 24 GLN HBy 1.0 1.8 2.8 1528 889 A 24 GLN HBx A 24 GLN H 1.0 1.8 2.8 1529 890 A 24 GLN H A 24 GLN HGy 1.0 1.8 3.5 1530 890 A 24 GLN HGx A 24 GLN H 1.0 1.8 3.5 1531 891 A 24 GLN H A 24 GLN HGy 1.0 1.8 4.5 1532 891 A 24 GLN HGx A 24 GLN H 1.0 1.8 4.5 1533 892 A 25 HIS H A 24 GLN HBy 1.0 1.8 3.5 1534 892 A 24 GLN HBx A 25 HIS H 1.0 1.8 3.5 1535 893 A 25 HIS H A 24 GLN H 1.0 1.8 3.5 1536 894 A 25 HIS HB3 A 25 HIS H 1.0 1.8 2.8 1537 895 A 25 HIS HB2 A 25 HIS H 1.0 1.8 2.8 1538 896 A 25 HIS HA A 26 TYR H 1.0 1.8 4.5 1539 897 A 25 HIS H A 26 TYR H 1.0 1.8 2.8 1540 898 A 26 TYR HA A 26 TYR H 1.0 1.8 3.5 1541 899 A 26 TYR HD% A 26 TYR H 1.0 1.8 4.5 1542 900 A 26 TYR H A 27 ILE H 1.0 1.8 4.5 1543 901 A 27 ILE HB A 27 ILE H 1.0 1.8 5.5 1544 902 A 24 GLN HA A 28 GLY H 1.0 1.8 4.5 1545 903 A 27 ILE HA A 28 GLY H 1.0 1.8 5.5 1546 904 A 27 ILE HB A 28 GLY H 1.0 1.8 4.5 1547 905 A 27 ILE HG2% A 28 GLY H 1.0 1.8 5.5 1548 906 A 27 ILE H A 28 GLY H 1.0 1.8 4.5 1549 907 A 27 ILE H A 28 GLY H 1.0 1.8 4.5 1550 908 A 28 GLY H A 28 GLY HAy 1.0 1.8 4.5 1551 908 A 28 GLY H A 28 GLY HAx 1.0 1.8 4.5 1552 909 A 28 GLY H A 28 GLY HAy 1.0 1.8 3.5 1553 909 A 28 GLY H A 28 GLY HAx 1.0 1.8 3.5 1554 910 A 27 ILE HG2% A 29 TRP H 1.0 1.8 5.5 1555 911 A 28 GLY H A 29 TRP H 1.0 1.8 5.5 1556 912 A 29 TRP HD1 A 29 TRP HE1 1.0 1.8 2.8 1557 913 A 29 TRP HA A 29 TRP H 1.0 1.8 5.5 1558 914 A 29 TRP HE1 A 29 TRP HZ2 1.0 1.8 2.8 1559 915 A 30 CYS HB2 A 24 GLN HE2x 1.0 1.8 5.5 1560 915 A 30 CYS HB2 A 24 GLN HE2y 1.0 1.8 5.5 1561 916 A 29 TRP HA A 30 CYS H 1.0 1.8 2.8 1562 917 A 29 TRP HD1 A 30 CYS H 1.0 1.8 5.5 1563 918 A 29 TRP H A 30 CYS H 1.0 1.8 5.5 1564 919 A 30 CYS HA A 30 CYS H 1.0 1.8 3.5 1565 920 A 30 CYS HB3 A 30 CYS H 1.0 1.8 4.5 1566 921 A 30 CYS HB2 A 30 CYS H 1.0 1.8 3.5 1567 922 A 32 PHE H A 31 PRO HBy 1.0 1.8 5.5 1568 922 A 31 PRO HBx A 32 PHE H 1.0 1.8 5.5 1569 923 A 33 TRP HE3 A 32 PHE H 1.0 1.8 5.5 1570 924 A 33 TRP H A 32 PHE HBx 1.0 1.8 4.5 1571 924 A 32 PHE HBy A 33 TRP H 1.0 1.8 4.5 1572 925 A 32 PHE H A 33 TRP H 1.0 1.8 4.5 1573 926 A 32 PHE H A 33 TRP H 1.0 1.8 2.8 1574 927 A 33 TRP HD1 A 33 TRP HE1 1.0 1.8 2.8 1575 928 A 33 TRP HB3 A 33 TRP H 1.0 1.8 3.5 1576 929 A 33 TRP HB2 A 33 TRP H 1.0 1.8 2.8 1577 930 A 33 TRP HE3 A 33 TRP H 1.0 1.8 3.5 1578 931 A 33 TRP HZ2 A 33 TRP HE1 1.0 1.8 2.8 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 6 PRO C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -95.0 -35.0 PHI 2 2 A 7 GLU C A 8 GLN N A 8 GLN CA A 8 GLN C 1.0 -95.0 -35.0 PHI 3 3 A 8 GLN C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -95.0 -35.0 PHI 4 4 A 9 VAL C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -95.0 -35.0 PHI 5 5 A 10 ASP C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -95.0 -35.0 PHI 6 6 A 11 LYS C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -95.0 -35.0 PHI 7 7 A 12 LEU C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -95.0 -35.0 PHI 8 8 A 13 ILE C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -95.0 -35.0 PHI 9 9 A 15 GLN C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -95.0 -35.0 PHI 10 10 A 16 ALA C A 17 THR N A 17 THR CA A 17 THR C 1.0 -95.0 -35.0 PHI 11 11 A 17 THR C A 18 SER N A 18 SER CA A 18 SER C 1.0 -95.0 -35.0 PHI 12 12 A 18 SER C A 19 ILE N A 19 ILE CA A 19 ILE C 1.0 -95.0 -35.0 PHI 13 13 A 19 ILE C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -95.0 -35.0 PHI 14 14 A 20 GLU C A 21 ARG N A 21 ARG CA A 21 ARG C 1.0 -95.0 -35.0 PHI 15 15 A 21 ARG C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -95.0 -35.0 PHI 16 16 A 22 LEU C A 23 CYS N A 23 CYS CA A 23 CYS C 1.0 -95.0 -35.0 PHI 17 17 A 23 CYS C A 24 GLN N A 24 GLN CA A 24 GLN C 1.0 -95.0 -35.0 PHI 18 18 A 24 GLN C A 25 HIS N A 25 HIS CA A 25 HIS C 1.0 -95.0 -35.0 PHI 19 19 A 25 HIS C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -105.0 -25.0 PHI 20 20 A 26 TYR C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -105.0 -25.0 PHI 21 21 A 29 TRP C A 30 CYS N A 30 CYS CA A 30 CYS C 1.0 -160.0 -80.0 PHI 22 22 A 1 ASN C A 2 GLU N A 2 GLU CA A 2 GLU C 1.0 -180.0 0.0 PHI 23 23 A 2 GLU C A 3 LEU N A 3 LEU CA A 3 LEU C 1.0 -180.0 0.0 PHI 24 24 A 3 LEU C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -180.0 0.0 PHI 25 25 A 31 PRO C A 32 PHE N A 32 PHE CA A 32 PHE C 1.0 -180.0 0.0 PHI 26 26 A 4 ASP N A 4 ASP CA A 4 ASP CB A 4 ASP CG 1.0 30.0 90.0 CHI1 27 27 A 12 LEU N A 12 LEU CA A 12 LEU CB A 12 LEU CG 1.0 -90.0 -30.0 CHI1 28 28 A 13 ILE N A 13 ILE CA A 13 ILE CB A 13 ILE CG1 1.0 -90.0 -30.0 CHI1 29 29 A 14 GLN N A 14 GLN CA A 14 GLN CB A 14 GLN CG 1.0 -90.0 -30.0 CHI1 30 30 A 15 GLN N A 15 GLN CA A 15 GLN CB A 15 GLN CG 1.0 -90.0 -30.0 CHI1 31 31 A 17 THR N A 17 THR CA A 17 THR CB A 17 THR OG1 1.0 30.0 90.0 CHI1 32 32 A 18 SER N A 18 SER CA A 18 SER CB A 18 SER OG 1.0 -90.0 -30.0 CHI1 33 33 A 19 ILE N A 19 ILE CA A 19 ILE CB A 19 ILE CG1 1.0 -90.0 -30.0 CHI1 34 34 A 22 LEU N A 22 LEU CA A 22 LEU CB A 22 LEU CG 1.0 -90.0 -30.0 CHI1 35 35 A 23 CYS N A 23 CYS CA A 23 CYS CB A 23 CYS SG 1.0 30.0 90.0 CHI1 36 36 A 25 HIS N A 25 HIS CA A 25 HIS CB A 25 HIS CG 1.0 150.0 210.0 CHI1 37 37 A 26 TYR N A 26 TYR CA A 26 TYR CB A 26 TYR CG 1.0 -90.0 -30.0 CHI1 38 38 A 27 ILE N A 27 ILE CA A 27 ILE CB A 27 ILE CG1 1.0 -90.0 -30.0 CHI1 39 39 A 30 CYS N A 30 CYS CA A 30 CYS CB A 30 CYS SG 1.0 -90.0 -30.0 CHI1 40 40 A 33 TRP N A 33 TRP CA A 33 TRP CB A 33 TRP CG 1.0 -90.0 -30.0 CHI1 41 41 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 GLN N 1.0 -70.0 -10.0 PSI 42 42 A 8 GLN N A 8 GLN CA A 8 GLN C A 9 VAL N 1.0 -70.0 -10.0 PSI 43 43 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 ASP N 1.0 -70.0 -10.0 PSI 44 44 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 LYS N 1.0 -70.0 -10.0 PSI 45 45 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 LEU N 1.0 -70.0 -10.0 PSI 46 46 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 ILE N 1.0 -70.0 -10.0 PSI 47 47 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 GLN N 1.0 -70.0 -10.0 PSI 48 48 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 GLN N 1.0 -70.0 -10.0 PSI 49 49 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 THR N 1.0 -70.0 -10.0 PSI 50 50 A 17 THR N A 17 THR CA A 17 THR C A 18 SER N 1.0 -70.0 -10.0 PSI 51 51 A 18 SER N A 18 SER CA A 18 SER C A 19 ILE N 1.0 -70.0 -10.0 PSI 52 52 A 19 ILE N A 19 ILE CA A 19 ILE C A 20 GLU N 1.0 -70.0 -10.0 PSI 53 53 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 ARG N 1.0 -70.0 -10.0 PSI 54 54 A 21 ARG N A 21 ARG CA A 21 ARG C A 22 LEU N 1.0 -70.0 -10.0 PSI 55 55 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 CYS N 1.0 -70.0 -10.0 PSI 56 56 A 23 CYS N A 23 CYS CA A 23 CYS C A 24 GLN N 1.0 -70.0 -10.0 PSI 57 57 A 24 GLN N A 24 GLN CA A 24 GLN C A 25 HIS N 1.0 -70.0 -10.0 PSI 58 58 A 25 HIS N A 25 HIS CA A 25 HIS C A 26 TYR N 1.0 -70.0 -10.0 PSI 59 59 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 GLY N 1.0 -80.0 -20.0 PSI 60 60 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 ILE N 1.0 -80.0 -20.0 PSI 61 61 A 30 CYS N A 30 CYS CA A 30 CYS C A 31 PRO N 1.0 70.0 170.0 PSI stop_ save_